SCHEMBL7879611

SCHEMBL7879611

N#Cc1ccc(CC(=O)NCc2ccc(Cl)cc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.66
▸ KMT2A Q03164 5/20 0.66
▸ ALDH1A1 P00352 3/20 0.66
▸ NPC1 O15118 1/20 0.66
▸ RAB9A P51151 1/20 0.66
▸ CA12 O43570 1/20 0.59
▸ CA1 P00915 1/20 0.59
▸ CA2 P00918 1/20 0.59
▸ CA9 Q16790 1/20 0.59
▸ ERCC1 P07992 2/20 0.58
▸ ERCC4 Q92889 2/20 0.58
▸ S1PR1 P21453 2/20 0.53
▸ S1PR3 Q99500 2/20 0.53
▸ POLB P06746 1/20 0.52
▸ CNR1 P21554 1/20 0.52
▸ PPARA Q07869 2/20 0.50
▸ AKR1B1 P15121 1/20 0.50
▸ LMNA P02545 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ TSHR P16473 1/20 0.50

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
SCHEMBL16082991 0.87 ALDH1A1 (0.83) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL9271150 0.86 ERCC1 (0.54) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL6391038 0.86 ALDH1A1 (0.67) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL7435071 0.85 ERCC1 (0.50) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL24821237 0.83 KMT2A (0.77) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL5315364 0.81 EPHX2 (0.52) MEN1KMT2AALDH1A1RAB9ACA12
SCHEMBL7285179 0.81 ALDH1A1 (0.73) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL5860896 0.81 ALDH1A1 (0.73) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL17372408 0.78 CA12 (0.50) MEN1KMT2AALDH1A1CA12CA1
SCHEMBL20932707 0.78 ERCC1 (0.49) KMT2AALDH1A1NPC1RAB9ACA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6326500-B1 ANTIINFLAMMATORY AGENTS; ANTIALLERGENS ABBOTT LABORATORIES 2001-12-04 — — US disclosed
US-6215001-B1 ANTIINFLAMMATORY AGENTS, ANTIASTHMATICS, AND ANTIALLERGENS; SIDE EFFECT REDUCTION KNOLL AKTIENGESELLSCHAFT (DE) 2001-04-10 — — US disclosed
US-6031109-A Phenoxy-, phenylthio-, benzoyl-alkyleneaminoalkylene-imidazole derivatives as therapeutic agents KNOLL AKTIENGESELLSCHAFT (DE) 2000-02-29 — — US disclosed
US-5780642-A NON-STEROIDAL ANTIINFLAMMATORY AGENT WHICH BLOCKS RELEASE OF ARACHIDONIC ACID FROM PHOSPHOLIPIDS; SIDE EFFECT REDUCTION KNOLL AKTIENGESELLSCHAFT (DE) 1998-07-14 — — US disclosed
EP-0705251-A1 IMIDAZOLE DERIVATIVES AS THERAPEUTIC AGENTS Knoll AG (DE) 1996-04-10 — — EP disclosed
WO-1995000493-A1 IMIDAZOLE DERIVATIVES AS THERAPEUTIC AGENTS KNOLL AG (DE) 1995-01-05 — — WO disclosed
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