SCHEMBL419400

SCHEMBL419400

CNCc1ccccc1Br

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.63
RIPK1 Q13546 1/20 0.47
CYP2A13 Q16696 1/20 0.46
IDO1 P14902 2/20 0.45
KDM4E B2RXH2 1/20 0.44
CYP3A4 P08684 1/20 0.44
MAPT P10636 1/20 0.44
KDM1A O60341 1/20 0.44
SLC6A4 P31645 3/20 0.44
SLC6A2 P23975 2/20 0.44
SLC6A3 Q01959 2/20 0.44
LTA4H P09960 1/20 0.44
KMT2A Q03164 1/20 0.43
TSHR P16473 1/20 0.42
HPGD P15428 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
HTR2A P28223 1/20 0.42
IFNAR1 P17181 1/20 0.42
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL28879805 0.82 TAAR1 (0.48) TAAR1RIPK1KDM4ECYP3A4MAPT
SCHEMBL31265560 0.82 SLC6A4 (0.57) TAAR1KDM4ECYP3A4MAPTSLC6A4
SCHEMBL8016874 0.82 SLC6A4 (0.57) TAAR1KDM4ECYP3A4MAPTSLC6A4
SCHEMBL6910479 0.80 TAAR1 (0.47) TAAR1RIPK1KDM4ECYP3A4MAPT
SCHEMBL19233952 0.79 TAAR1 (0.46) TAAR1KDM4ECYP3A4MAPTSLC6A4
SCHEMBL14630026 0.77 RIPK1 (0.49) TAAR1RIPK1IDO1KDM1ASLC6A4
SCHEMBL3056754 0.77 TAAR1 (1.00) TAAR1IDO1KDM4EKMT2ATSHR
SCHEMBL8703610 0.76 TAAR1 (0.64) TAAR1CYP2A13IDO1TSHRALDH1A1
SCHEMBL29930048 0.76 TAAR1 (0.64) TAAR1CYP2A13IDO1TSHRALDH1A1
SCHEMBL11194513 0.76 KMT2A (0.47) TAAR1RIPK1CYP2A13IDO1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4737453-A1 NOVEL SELENOPHENE DERIVATIVES Aigen Sciences Inc. (KR) 2026-05-06 EP disclosed
US-20250382290-A1 SALTS OF SOS1 INHIBITORS Mirati Therapeutics, Inc. (US) 2025-12-18 US disclosed
US-20250270220-A1 SOS1 INHIBITORS Mirati Therapeutics, Inc. (US) 2025-08-28 US disclosed
US-12304915-B2 SOS1 inhibitors Mirati Therapeutics, Inc. (US) 2025-05-20 US disclosed
CN-119546304-A Salts of SOS1 inhibitors 米拉蒂治疗公司 2025-02-28 CN disclosed
US-20250059182-A1 SOS1 INHIBITORS MIRATI THERAPEUTICS, INC 2025-02-20 US disclosed
CN-119462626-A SOS1 inhibitors 米拉蒂治疗股份有限公司 2025-02-18 CN disclosed
WO-2025005748-A1 NOVEL SELENOPHENE DERIVATIVES (주)아이젠사이언스 2025-01-02 WO disclosed
CN-115135315-B SOS1 inhibitors 米拉蒂治疗股份有限公司 2024-11-26 CN disclosed
US-20240109887-A1 NOVEL SUBSTITUTED BICYCLIC AZA-HETEROCYCLES AS SOS1 INHIBITORS VIVA STAR BIOSCIENCES (SUZHOU) CO., LTD. (CN) 2024-04-04 US disclosed
EP-1448187-A2 COMPOUNDS DERIVED FROM AN AMINE NUCLEUS AND PHARMACEUTICAL COMPOSITIONS COMPRISING SAME Bristol-Myers Squibb Company (US) 2004-08-25 EP disclosed
US-20040029940-A1 Methods of treating factor VIIa-associated conditions with compounds having an amine nucleus BRISTOL-MYERS SQUIBB COMPANY 2004-02-12 US disclosed
WO-2004000788-A1 UREIDO-SUBSTITUTED ANILINE COMPOUNDS USEFUL AS SERINE PROTEASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2003-12-31 WO disclosed
WO-2004000214-A2 USE OF COMPOUNDS HAVING AN AMINE NUCLEUS IN MANUFACTURE OF A MEDICAMENT USEFUL FOR TREATING FACTOR VIIA-ASSOCIATED CONDITIONS BRISTOL-MYERS SQUIBB COMPANY (US) 2003-12-31 WO disclosed
US-6596747-B2 For therapy of diseases associdated with Factor VIIa and or inosine monophosphate dehydrogenase (IMPDH) BRISTOL-MYERS SQUIBB COMPANY 2003-07-22 US disclosed
WO-2003047512-A2 COMPOUNDS DERIVED FROM AN AMINE NUCLEUS AND PHARMACEUTICAL COMPOSITIONS COMPRISING SAME BRISTOL-MYERS SQUIBB COMPANY (US) 2003-06-12 WO disclosed
EP-0871653-B1 NOVEL AMINO ACID DERIVATIVES, METHODS OF PRODUCING THEM, AND PHARMACEUTICAL COMPOUNDS CONTAINING THESE COMPOUNDS BOEHRINGER INGELHEIM PHARMA (DE) 2003-03-26 EP disclosed
US-20020143176-A1 Compounds derived from an amine nucleus and pharmaceutical compositions comprising same BRISTOL-MYERS SQUIBB COMPANY 2002-10-03 US disclosed
US-6232468-B1 ANTIINFLAMMATORY AGENT BOEHRINGER INGELHEIM KG (DE) 2001-05-15 US disclosed
EP-0871653-A1 NOVEL AMINO ACID DERIVATIVES, METHODS OF PRODUCING THEM, AND PHARMACEUTICAL COMPOUNDS CONTAINING THESE COMPOUNDS Boehringer Ingelheim Pharma GmbH & Co.KG (DE) 1998-10-21 EP 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-20250382290-A1 SALTS OF SOS1 INHIBITORS SOS1, SOS2, SOST TAAR1 4531/4885RIPK1 1927/4885CYP2A13 4373/4885
US-12304915-B2 SOS1 inhibitors SOS1, SOS2, SAV1 TAAR1 4552/4885RIPK1 1301/4885CYP2A13 4756/4885
US-20250059182-A1 SOS1 INHIBITORS SOS1, SOS2, SOST TAAR1 4603/4885RIPK1 1317/4885CYP2A13 4722/4885
US-20020143176-A1 Compounds derived from an amine nucleus and pharmaceutical compositions comprising same IMPDH1, IMPDH2, IMPA1 TAAR1 2587/4885RIPK1 3609/4885CYP2A13 461/4885
US-20040029940-A1 Methods of treating factor VIIa-associated conditions with compounds having an amine nucleus F7, F8, F13B TAAR1 766/4885RIPK1 4871/4885CYP2A13 1081/4885
US-20250270220-A1 SOS1 INHIBITORS SOS1, SOS2, SAV1 TAAR1 4552/4885RIPK1 1301/4885CYP2A13 4756/4885
US-20240109887-A1 NOVEL SUBSTITUTED BICYCLIC AZA-HETEROCYCLES AS SOS1 INHIBITORS SOS1, SOS2, KSR1 TAAR1 3556/4885RIPK1 468/4885CYP2A13 2962/4885

“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.