SCHEMBL5347452

SCHEMBL5347452

C=C(C)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 4/20 0.50
ALDH1A1 P00352 4/20 0.50
NPC1 O15118 3/20 0.50
RAB9A P51151 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 2/20 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
SCHEMBL18872367 0.86 PTPN1 (0.53) TAS2R38HSD17B10NAPRTMAPTALDH1A1
SCHEMBL19825999 0.86 SMN1; SMN2 (0.46) TAS2R38HSD17B10NAPRTMAPTALDH1A1
SCHEMBL15743709 0.83 TAS2R38 (0.52) TAS2R38HSD17B10NAPRTMAPTALDH1A1
SCHEMBL18473288 0.81 MGLL (0.61) NPC1RAB9ASMN1; SMN2TSHRKMT2A
SCHEMBL19263968 0.81 HPGD (0.61) MAPTALDH1A1NPC1RAB9AEPHX1
SCHEMBL14301712 0.80 TAS2R38 (0.54) TAS2R38HSD17B10NAPRTMAPTALDH1A1
SCHEMBL14347597 0.78 TAS2R38 (0.64) TAS2R38HSD17B10NAPRTMAPTALDH1A1
SCHEMBL14347590 0.78 TAS2R38 (0.64) TAS2R38HSD17B10NAPRTMAPTALDH1A1
SCHEMBL8151745 0.78 HSD17B10 (0.55) TAS2R38HSD17B10NAPRTALDH1A1NPC1
SCHEMBL22100361 0.78 HSD17B10 (0.55) TAS2R38HSD17B10NAPRTALDH1A1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108484472-A A kind of synthetic method of thioindole quinoline class compound 华中科技大学 2018-09-04 CN claimed
CN-100402610-C Dye mixtures, their preparation method and their use CIBA SPECILITY CHEMICALS HOLDI (CH) 2008-07-16 CN claimed
CN-1097076-C Active dye, their preparation and use CIBA SPECIALTY CHEMICALS HOLSI (CH) 2002-12-25 CN claimed
CN-1350036-A Dye mixtures, their preparation method and their use CIBA SPECILITY CHEMICALS HOLDI (CH) 2002-05-22 CN claimed
CN-1058012-C Reactive dyes from dioxazine series, their preparation and use CIBA SC HOLDING AG (CH) 2000-11-01 CN claimed
CN-1163291-A Active dye, their preparation and use CIBA GEIGY AG (CH) 1997-10-29 CN claimed
CN-1146468-A Dye mixtures, process for their preparation and their use CIBA GEIGY AG (CH) 1997-04-02 CN claimed
CN-1142500-A Reactive dyes from dioxazine series, their preparation and use CIBA GEIGY AG (CH) 1997-02-12 CN claimed
CN-1104227-A Reactive dyes, their preparation and their use CIBA GEIGY AG (CH) 1995-06-28 CN claimed
JP-61282349-A None JP disclosed
JP-2024316-A None JP disclosed
JP-3021616-A None JP disclosed
JP-56131566-A None JP disclosed
US-12528916-B2 Transmembrane pH-gradient polymersomes ETH ZURICH (CH) 2026-01-20 US disclosed
EP-0099516-A1 Process for the preparation of bis(aminocyclohexyl)dialkyl methanes BASF Aktiengesellschaft (DE) 1984-02-01 EP disclosed
US-4401777-A Curable resin composition comprising N-(alkenylphenyl)maleimide and epoxy composition MITSUI TOATSU CHEMICALS, INC. (JP) 1983-08-30 US disclosed
EP-0077840-A1 Curable resin composition MITSUI TOATSU CHEMICALS, Inc. (JP) 1983-05-04 EP disclosed
US-4323662-A Thermosetting resin compositions comprising bismaleimides and alkenylaniline derivatives MITSUI TOATSU CHEMICALS, INC. (JP) 1982-04-06 US disclosed
JP-S56131566-A MALEIMIDE DERIVATIVE AND ITS PREPARATION MITSUI TOATSU CHEM INC 1981-10-15 JP disclosed
US-4156757-A Electrically conductive perylene derivatives BASF AKTIENGESELLSCHAFT (DE) 1979-05-29 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 (1 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-12528916-B2 Transmembrane pH-gradient polymersomes AQP4, ABCB11, SLC6A6 TAS2R38 110/4885HSD17B10 2121/4885NAPRT 4180/4885

“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.