SCHEMBL128995

SCHEMBL128995

CCCN(CCC)c1cc[c]cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.37
ERBB2 P04626 2/20 0.37
ESRRG P62508 1/20 0.34
CNR2 P34972 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
MAPK1 P28482 2/20 0.33
ALDH1A1 P00352 2/20 0.33
PSMD14 O00487 1/20 0.33
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
RECQL P46063 1/20 0.33
GFER P55789 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
NPSR1 Q6W5P4 2/20 0.33
MAPT P10636 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
HTT P42858 1/20 0.32
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL4719828 0.92 EGFR (0.38) EGFRERBB2CNR2ALDH1A1GFER
SCHEMBL4722449 0.91 ALDH1A1 (0.40) EGFRERBB2ESRRGCNR2L3MBTL1
SCHEMBL7035417 0.90 EGFR (0.50) EGFRERBB2ESRRGCNR2ALDH1A1
SCHEMBL11329200 0.88 CRHR1 (0.39) MAPK1ALDH1A1TSHRMAPTSMN1; SMN2
SCHEMBL26911777 0.87 HRH3 (0.39) EGFRERBB2ESRRGCNR2L3MBTL1
SCHEMBL126299 0.86 EGFR (0.40) EGFRERBB2CNR2ALDH1A1GFER
SCHEMBL1080080 0.85 EGFR (0.36) EGFRERBB2CNR2NPC1RAB9A
SCHEMBL9800564 0.83 DNM1 (0.38) EGFRERBB2CNR2NPC1RAB9A
SCHEMBL9800597 0.83 DNM1 (0.38) EGFRERBB2CNR2NPC1RAB9A
SCHEMBL2460601 0.83 DNM1 (0.38) EGFRERBB2CNR2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107141391-B Ethylene-polar styrene quasi-random copolymer and preparation method thereof 中国科学院长春应用化学研究所 2020-03-13 CN claimed
US-20110166132-A1 Gamma Secretase Modulators AMGEN INC. (US) 2011-07-07 US claimed
EP-2231602-A1 GAMMA SECRETASE MODULATORS Amgen, Inc (US) 2010-09-29 EP claimed
WO-2009075874-A1 GAMMA SECRETASE MODULATORS AMGEN INC. (US) 2009-06-18 WO claimed
US-7247687-B2 Late transition metal catalysts for olefin polymerization and oligomerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-07-24 US claimed
EP-1521758-B1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEM PATENTS INC (US) 2006-05-24 EP claimed
US-20060047094-A1 Late transition metal catalysts for olefin polymerization and oligomerization EXXONMOBIL CHEMICAL PATENTS INC. 2006-03-02 US claimed
EP-1521758-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION Exxonmobil Chemical Patents Inc. (US) 2005-04-13 EP claimed
WO-2004007509-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-01-22 WO claimed
US-5492792-A OPTICAL CARD OR DISKS; EXCELLENT LIGHT SENSITIVITY WITHIN NEAR INFRARED REGION AND HEAT RESISTANCE; STORE INFORMATIONSAT HIGH DENSITY CANON KABUSHIKI KAISHA (JP) 1996-02-20 US claimed
EP-0402667-B1 Diarylimidazoles BOEHRINGER MANNHEIM GMBH (DE) 1994-02-02 EP claimed
US-4454211-A Electrophotographic photosensitive member with pyrazoline charge transport material CANON KABUSHIKI KAISHA (JP) 1984-06-12 US claimed
US-4420548-A Electrophotographic member with hydrazone or ketazine compounds CANON KABUSHIKI KAISHA (JP) 1983-12-13 US claimed
US-4145215-A PHOTOCONDUCTIVE PIGMENTS EASTMAN KODAK COMPANY (US) 1979-03-20 US claimed
US-20220404729-A1 TONER PARTICLES FOR DEVELOPING ELECTROSTATICALLY CHARGED IMAGE AND TONER COMPOSITION FOR DEVELOPING ELECTROSTATICALLY CHARGED IMAGE TOMOEGAWA CORPORATION (JP) 2022-12-22 US disclosed
CN-112513238-A Stable compositions comprising leuco compounds 美利肯公司 2021-03-16 CN disclosed
CN-107141391-B Ethylene-polar styrene quasi-random copolymer and preparation method thereof 中国科学院长春应用化学研究所 2020-03-13 CN disclosed
US-4025341-A CONDENSATION POLYMER OF A TERTIARY AROMATIC AMINE, A SENSITIZER, AND A CARBONYL COMPOUND EASTMAN KODAK COMPANY (US) 1977-05-24 US disclosed
US-4012376-A Photosensitive colorant materials EASTMAN KODAK COMPANY (US) 1977-03-15 US disclosed
US-4008330-A A P-AMINOPHENYL-THIOUREA NIPPON KAYAKU KABUSHIKI KAISHA (JA) 1977-02-15 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 (2 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-20060047094-A1 Late transition metal catalysts for olefin polymerization and oligomerization MLX, LOX, LMTK3 EGFR 1813/4885ERBB2 936/4885ESRRG 3303/4885
US-20110166132-A1 Gamma Secretase Modulators BACE1, BACE2, PSEN1 EGFR 3101/4885ERBB2 2732/4885ESRRG 176/4885

“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.