SCHEMBL7879462

SCHEMBL7879462

CCCCC(=O)c1cc(C#N)ccc1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.48
▸ ALDH1A1 P00352 2/20 0.44
▸ HPGD P15428 1/20 0.44
▸ ALOX15 P16050 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ RECQL P46063 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ HSD17B3 P37058 2/20 0.42
▸ TMPRSS4 Q9NRS4 2/20 0.42
▸ IAPP P10997 2/20 0.40
▸ MGLL Q99685 2/20 0.40
▸ FFAR1 O14842 1/20 0.40
▸ PLA2G2A P14555 1/20 0.40
▸ PLA2G5 P39877 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ KAT8 Q9H7Z6 2/20 0.39

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
SCHEMBL11066386 0.84 HSP90AB1 (0.47) ALDH1A1HPGDALOX15TSHRRECQL
SCHEMBL11581970 0.81 FFAR1 (0.44) HTTTMPRSS4FFAR1MEN1KMT2A
SCHEMBL31360514 0.79 HTT (0.68) HTTALDH1A1HPGDALOX15TSHR
SCHEMBL21018531 0.79 HTT (0.68) HTTALDH1A1HPGDALOX15TSHR
SCHEMBL8712689 0.78 CSNK2A1 (0.55) HTTALDH1A1HPGDALOX15TSHR
SCHEMBL10366080 0.76 HPGD (0.55) HTTALDH1A1HPGDALOX15TSHR
SCHEMBL8712803 0.76 HTT (0.54) HTTALDH1A1HPGDALOX15TSHR
SCHEMBL8466864 0.76 HSD17B3 (0.62) HSD17B3MGLLHTR7
SCHEMBL311893 0.75 TMPRSS4 (0.52) HTTALDH1A1HPGDTMPRSS4MAPT
SCHEMBL8392909 0.74 KAT8 (0.70) HTTHSD17B10IAPPMEN1MAPT

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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