SCHEMBL1687694

SCHEMBL1687694

CC(=N)Nc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS2R38 P59533 3/20 0.58
HSD17B10 Q99714 3/20 0.58
NAPRT Q6XQN6 1/20 0.58
MAPT P10636 5/20 0.50
NPC1 O15118 3/20 0.50
RAB9A P51151 3/20 0.50
ALDH1A1 P00352 3/20 0.50
EPHX1 P07099 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
TAAR1 Q96RJ0 2/20 0.50
TP53 P04637 2/20 0.50
TSHR P16473 2/20 0.50
KMT2A Q03164 2/20 0.50
EPHX2 P34913 1/20 0.50
CDK9 P50750 1/20 0.50
CLK4 Q9HAZ1 1/20 0.50
CYP3A4 P08684 1/20 0.50
POLB P06746 1/20 0.50
GAA P10253 4/20 0.47
KDM4E B2RXH2 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7865767 0.82 POLB (0.47) HSD17B10MAPTRAB9AALDH1A1TP53
SCHEMBL20870051 0.81 MGLL (0.61) MAPTTP53KMT2APOLBKDM4E
Acetic Acid SCHEMBL30876192 0.78 NAPRT (0.64) TAS2R38HSD17B10NAPRTMAPTNPC1
SCHEMBL11763947 0.78 EPHX1 (0.67) TAS2R38HSD17B10MAPTNPC1RAB9A
SCHEMBL14347590 0.78 TAS2R38 (0.64) TAS2R38HSD17B10NAPRTMAPTNPC1
SCHEMBL35172 0.78 HSD17B10 (0.55) TAS2R38HSD17B10NAPRTMAPTNPC1
SCHEMBL13381399 0.78 TAS2R38 (0.64) TAS2R38HSD17B10NAPRTMAPTNPC1
SCHEMBL14347597 0.78 TAS2R38 (0.64) TAS2R38HSD17B10NAPRTMAPTNPC1
SCHEMBL1455001 0.78 TAS2R38 (0.64) TAS2R38HSD17B10NAPRTMAPTNPC1
SCHEMBL20163213 0.78 HSD17B10 (0.55) TAS2R38HSD17B10NAPRTMAPTNPC1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 56 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110627730-B Method for synthesizing 4-alkenyl quinazoline by C-H activation/cyclization reaction catalyzed by transition metal 四川大学 2022-07-05 CN claimed
US-20190134601-A1 BISPHENOL HYPERSORBENTS FOR ENHANCED DETECTION OF, OR PROTECTION FROM, HAZARDOUS CHEMICALS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2019-05-09 US claimed
CN-103242328-A p-N-methyl acetamidophenyl rhodamine 6G pH fluorescence molecular probe as well as preparation method and use thereof UNIV TIANJIN NORMAL 2013-08-14 CN claimed
EP-4540238-A1 MOLECULAR GLUE DEGRADERS AND METHODS OF USING THE SAME Monte Rosa Therapeutics AG (CH) 2025-04-23 EP disclosed
US-20250115582-A1 MOLECULAR GLUE DEGRADERS AND METHODS OF USING THE SAME MONTE ROSA THERAPEUTICS AG (CH) 2025-04-10 US disclosed
WO-2023244818-A1 MOLECULAR GLUE DEGRADERS AND METHODS OF USING THE SAME MONTE ROSA THERAPEUTICS, INC. (US) 2023-12-21 WO disclosed
US-20230371358-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-11-16 US disclosed
US-20230321073-A1 COMPOSITIONS AND METHODS FOR TREATING METABOLIC DYSREGULATION Response IP Holding Company, LLC (US) 2023-10-12 US disclosed
US-11779901-B2 Bisphenol hypersorbents for enhanced detection of, or protection from, hazardous chemicals THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2023-10-10 US disclosed
US-11738327-B2 Bisphenol hypersorbents for enhanced detection of, or protection from, hazardous chemicals THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2023-08-29 US disclosed
US-11654415-B2 Bisphenol hypersorbents for enhanced detection of, or protection from, hazardous chemicals THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2023-05-23 US disclosed
EP-0433808-A2 Process for vulcanising polychloroprene BAYER AG (DE) 1991-06-26 EP disclosed
US-4652512-A DIAZONIUM COMPOUND KANZAKI PAPER MANUFACTURING COMPANY, LIMITED (JP) 1987-03-24 US disclosed
US-4018814-A ANTHELMINTICS BAYER AKTIENGESELLSCHAFT (DT) 1977-04-19 US disclosed
US-4018814-A ANTHELMINTICS BAYER AKTIENGESELLSCHAFT (DT) 1977-04-19 US disclosed
US-4013676-A NEMATOCIDES BAYER AKTIENGESELLSCHAFT (DT) 1977-03-22 US disclosed
US-4013676-A NEMATOCIDES BAYER AKTIENGESELLSCHAFT (DT) 1977-03-22 US disclosed
US-3996247-A ANTHELMINTIC BAYER AKTIENGESELLSCHAFT (DT) 1976-12-07 US disclosed
US-3996247-A ANTHELMINTIC BAYER AKTIENGESELLSCHAFT (DT) 1976-12-07 US disclosed
US-3818070-A CARBALIPHATIC-OXY AMINOPHENYLAMIDINES BAYER AG 1974-06-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190134601-A1 BISPHENOL HYPERSORBENTS FOR ENHANCED DETECTION OF, OR PROTECTION FROM, HAZARDOUS CHEMICALS SHBG, GSTP1, GSTA2 TAS2R38 3999/4885HSD17B10 443/4885NAPRT 2184/4885
US-11654415-B2 Bisphenol hypersorbents for enhanced detection of, or protection from, hazardous chemicals SHBG, GSTP1, GSTA2 TAS2R38 3999/4885HSD17B10 443/4885NAPRT 2184/4885
US-20230321073-A1 COMPOSITIONS AND METHODS FOR TREATING METABOLIC DYSREGULATION LIPC, CPT1A, CETP TAS2R38 4181/4885HSD17B10 181/4885NAPRT 1218/4885
US-11779901-B2 Bisphenol hypersorbents for enhanced detection of, or protection from, hazardous chemicals SHBG, GSTP1, GSTA2 TAS2R38 3999/4885HSD17B10 443/4885NAPRT 2184/4885
US-20230371358-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES LIFR, SOD1, ROS1 TAS2R38 1073/4885HSD17B10 4375/4885NAPRT 4821/4885
US-20250115582-A1 MOLECULAR GLUE DEGRADERS AND METHODS OF USING THE SAME PSMA1, CSNK1G1, CSNK1A1 TAS2R38 4465/4885HSD17B10 3168/4885NAPRT 3520/4885
US-11738327-B2 Bisphenol hypersorbents for enhanced detection of, or protection from, hazardous chemicals SHBG, GSTP1, GSTA2 TAS2R38 3999/4885HSD17B10 443/4885NAPRT 2184/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.