SCHEMBL9312640

SCHEMBL9312640

ClCc1ccc(I)c2ccccc12

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.35
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
TAAR1 Q96RJ0 1/20 0.31
IDO1 P14902 1/20 0.30

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
SCHEMBL29558862 0.85 L3MBTL1 (0.44) L3MBTL1KMT2AALDH1A1TSHRIDO1
SCHEMBL2466440 0.85 L3MBTL1 (0.44) L3MBTL1KMT2AALDH1A1TSHRIDO1
SCHEMBL15345312 0.77 LOXL2 (0.45) ALDH1A1TAAR1IDO1
SCHEMBL12983061 0.77 CNR2 (0.39) KMT2AALDH1A1
SCHEMBL29926858 0.77 ALDH1A1 (0.39) ALDH1A1TSHRTAAR1IDO1
SCHEMBL3193406 0.77 ALDH1A1 (0.39) ALDH1A1TSHRTAAR1IDO1
SCHEMBL29383544 0.75 ALDH1A1 (0.39) L3MBTL1KMT2AALDH1A1TSHR
SCHEMBL2468219 0.75 ALDH1A1 (0.39) L3MBTL1KMT2AALDH1A1TSHR
SCHEMBL9314804 0.74 MAPT (0.39) L3MBTL1KMT2AALDH1A1TSHR
SCHEMBL7915217 0.74 CYP2A6 (0.62) L3MBTL1KMT2AALDH1A1TSHRIDO1

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE34770-E 1-benzothiophene derivatives; side effect reduction KAKEN PHARMACEUTICAL CO., LTD. (JP) 1994-11-01 US disclosed
US-5334628-A Amine derivatives, processes for preparing the same and fungicides containing the same KAKEN PHARMACEUTICAL CO., LTD. (JP) 1994-08-02 US disclosed
US-5200423-A AMINE DERIVATIVES, PROCESSES FOR PREPARING THE SAME AND FUNGICIDES CONTAINING THE SAME KAKEN PHARMACEUTICAL CO., LTD. (JP) 1993-04-06 US disclosed
US-5106866-A Skin disorders KAKEN PHARMACEUTICAL CO., LTD. (JP) 1992-04-21 US disclosed
US-5021458-A Amine derivatives and fungicides containing the same KAKEN PHARMACEUTICAL CO., LTD. (JP) 1991-06-04 US disclosed
EP-0164697-B1 AMINE DERIVATIVES, PROCESSES FOR PREPARING THE SAME AND FUNGICIDES CONTAINING THE SAME Kaken Pharmaceutical Co., Ltd. (JP) 1990-11-07 EP disclosed
CN-1007975-B Process for the preparation of amine derivatives KAKEN PHARMACEUFICAL CO LTD (JP) 1990-05-16 CN disclosed
CN-1035771-A Process for the preparation of amine derivatives and fungicides containing amine derivatives SCIENT RESEARCH AND PHARMACEUT (JP) 1989-09-27 CN disclosed
CN-85104330-A Process for the preparation of amine derivatives and fungicides containing amine derivatives 1986-12-03 CN disclosed
EP-0164697-A2 Amine derivatives, processes for preparing the same and fungicides containing the same Kaken Pharmaceutical Co., Ltd. (JP) 1985-12-18 EP disclosed