SCHEMBL903704

SCHEMBL903704

CC(Cc1ccccc1)Nc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 9/20 0.63
TAAR1 Q96RJ0 3/20 0.63
SLC18A2 Q05940 1/20 0.63
CYP3A4 P08684 2/20 0.58
TSHR P16473 2/20 0.58
ALDH1A1 P00352 1/20 0.58
ALOX15 P16050 1/20 0.58
ALOX12 P18054 1/20 0.58
MAPK1 P28482 1/20 0.58
HIF1A Q16665 1/20 0.58
HSD17B10 Q99714 1/20 0.58
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
NPC1 O15118 1/20 0.55
RAB9A P51151 1/20 0.55
TDP1 Q9NUW8 1/20 0.54
CYP1A2 P05177 1/20 0.53
CYP2D6 P10635 1/20 0.53

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
SCHEMBL29020992 0.88 SIGMAR1 (0.55) SIGMAR1TAAR1SLC18A2CYP3A4TSHR
SCHEMBL5536511 0.87 SIGMAR1 (0.53) SIGMAR1TAAR1SLC18A2CYP3A4TSHR
SCHEMBL31443251 0.87 ALDH1A1 (0.50) SIGMAR1TAAR1SLC18A2CYP3A4TSHR
SCHEMBL31443252 0.87 SIGMAR1 (0.56) SIGMAR1TAAR1SLC18A2CYP3A4TSHR
SCHEMBL9320616 0.85 SIGMAR1 (0.53) SIGMAR1TAAR1SLC18A2CYP3A4TSHR
SCHEMBL970741 0.85 TAAR1 (0.66) SIGMAR1TAAR1SLC18A2CYP3A4TSHR
SCHEMBL3905889 0.85 SIGMAR1 (0.54) SIGMAR1TAAR1SLC18A2CYP3A4TSHR
SCHEMBL31443249 0.84 MEN1 (0.66) SIGMAR1ALDH1A1MAPK1MEN1KMT2A
SCHEMBL23929176 0.82 HIF1A (0.48) SIGMAR1TAAR1SLC18A2CYP3A4TSHR
SCHEMBL19061658 0.82 HIF1A (0.48) SIGMAR1TAAR1SLC18A2CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7635662-B2 Compound for color-producing composition, and recording material CHEMIPRO KASEI KAISHA, LTD. (JP) 2009-12-22 US claimed
US-5690726-A ADDING A LEWIS BASE SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1997-11-25 US claimed
CN-112118834-B Oral tablet for inducing saliva production 费尔廷制药公司 2024-01-02 CN disclosed
CN-112118831-B Tabletted chewing gum sweet suitable for active pharmaceutical ingredient 费尔廷制药公司 2023-04-21 CN disclosed
CN-112118832-B Buccal tablet dosage form for active ingredient 费尔廷制药公司 2023-04-21 CN disclosed
US-20160160089-A1 PRESSURE-SENSITIVE ADHESIVE SHEET TO BE USED IN PRODUCTION OF SEMICONDUCTOR NITTO DENKO CORPORATION (JP) 2016-06-09 US disclosed
WO-2012040853-A1 GROUP 5 METAL COMPLEXES USEFUL FOR AMINE FUNCTIONALIZATION AND SYNTHETIC PROCESS FOR MANUFACTURE THEREOF THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2012-04-05 WO disclosed
US-7807738-B2 Compound for color-producing composition, and recording material CHEMIPRO KASEI KAISHA, LTD. (JP) 2010-10-05 US disclosed
US-20100105941-A1 NOVEL COMPOUND FOR COLOR-PRODUCING COMPOSITION, AND RECORDING MATERIAL KABASHIMA KAZUO 2010-04-29 US disclosed
US-7635662-B2 Compound for color-producing composition, and recording material CHEMIPRO KASEI KAISHA, LTD. (JP) 2009-12-22 US disclosed
EP-1148093-B1 CONJUGATED DIENE RUBBER COMPOSITION FOR TIRE USE AND TIRE ZEON CORP (JP) 2007-01-10 EP disclosed
EP-1148093-A1 CONJUGATED DIENE RUBBER COMPOSITION FOR TIRE USE AND TIRE Nippon Zeon Co., Ltd. (JP) 2001-10-24 EP disclosed
EP-1146059-A1 RESIN MODIFIER, RESIN COMPOSITION CONTAINING THE SAME, AND POLYAROMATIC VINYL RESIN COMPOSITION Nippon Zeon Co., Ltd. (JP) 2001-10-17 EP disclosed
EP-1116713-A1 NOVEL COLOR-DEVELOPING COMPOUND AND RECORDING MATERIAL Asahi Kasei Kabushiki Kaisha (JP) 2001-07-18 EP disclosed
US-6222073-B1 REACTING AROMATIC OLEFIN WITH ANILINE COMPOUND IN INERT SOLVENT IN PRESENCE OF BASIC CATALYST SELECTED FROM ALKALI METAL OR ALKALINE EARTH METAL ALCOHOLATES, ALKALI METAL OR ALKALINE EARTH METAL AMIDES TO FORM N-ALKYLATED ANILINES AVENTIS RESEARCH & TECHNOLOGIES GMBH & CO. KG (DE) 2001-04-24 US disclosed
EP-1047661-A1 CATALYTIC SYNTHESIS OF N-ALKYLATED ANILINES FROM OLEFINS AND ANILINES Aventis Research & Technologies GmbH & Co. KG (DE) 2000-11-02 EP disclosed
WO-1999036388-A1 CATALYTIC SYNTHESIS OF N-ALKYLATED ANILINES FROM OLEFINS AND ANILINES AVENTIS RESEARCH & TECHNOLOGIES GMBH & CO. KG (DE) 1999-07-22 WO disclosed
US-5690726-A ADDING A LEWIS BASE SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1997-11-25 US disclosed
CN-1037330-A PROPANAMINE DERIVATIVES LILLY CO ELI (US) 1989-11-22 CN disclosed
US-4826752-A Dry photosensitive lithographic plate comprising a silicon rubber layer containing an aromatic aminosilane FUJI PHOTO FILM CO., LTD. (JP) 1989-05-02 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-20100105941-A1 NOVEL COMPOUND FOR COLOR-PRODUCING COMPOSITION, AND RECORDING MATERIAL UMPS, UROD, UGP2 SIGMAR1 1484/4885TAAR1 988/4885SLC18A2 2209/4885

“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.