SCHEMBL10737557

SCHEMBL10737557

C=C(C)Cc1ccc(C=O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.44
▸ CYP2A6 P11509 4/20 0.43
▸ ALDH5A1 P51649 1/20 0.43
▸ ABAT P80404 1/20 0.43
▸ ALDH1A1 P00352 7/20 0.41
▸ ALDH1A3 P47895 2/20 0.41
▸ ALDH3A1 P30838 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ KDM4E B2RXH2 2/20 0.39
▸ TYR P14679 1/20 0.39
▸ CYP2A13 Q16696 1/20 0.39
▸ EPHX2 P34913 1/20 0.38
▸ NR1H4 Q96RI1 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ EGFR P00533 1/20 0.35
▸ PTGS2 P35354 1/20 0.34
▸ RAB9A P51151 1/20 0.34

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
SCHEMBL6015468 0.82 ALDH1A1 (0.38) KMT2AALDH1A1MAPTHPGDSMN1; SMN2
SCHEMBL9129337 0.81 KMT2A (0.40) KMT2ACYP2A6ALDH5A1ABATALDH1A1
SCHEMBL8397324 0.81 ALDH1A1 (0.48) KMT2AALDH1A1LMNAMAPTHPGD
SCHEMBL17748388 0.81 HSD17B10 (0.35) KMT2AALDH1A1MAPTHPGDSMN1; SMN2
SCHEMBL1755559 0.81 KMT2A (0.49) KMT2ACYP2A6ALDH5A1ABATALDH1A1
SCHEMBL10816139 0.81 ALDH1A1 (0.45) KMT2ACYP2A6ALDH5A1ABATALDH1A1
SCHEMBL10550388 0.79 KMT2A (0.44) KMT2ACYP2A6ALDH5A1ABATALDH1A1
SCHEMBL9129340 0.78 KMT2A (0.42) KMT2ACYP2A6ALDH5A1ABATALDH1A1
SCHEMBL19591200 0.77 KMT2A (0.40) KMT2ACYP2A6ALDH5A1ABATALDH1A1
SCHEMBL9246634 0.77 KMT2A (0.37) KMT2ACYP2A6ALDH5A1ABATALDH1A1

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-4582903-A Synthesis of unsaturated hydantoins with an inexpensive catalyst STAUFFER CHEMICAL COMPANY (US) 1986-04-15 — — US claimed
US-4345072-A Process for the production of 5-arylidene hydantoins (B) DEGUSSA AG (DE) 1982-08-17 — — US claimed
US-7851658-B2 Palladium-catalyzed carbon-carbon bond forming reactions PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2010-12-14 — — US disclosed
US-4684735-A Promotion of raney nickel hydrogenation catalyst STAUFFER CHEMICAL COMPANY (US) 1987-08-04 — — US disclosed
US-4650876-A INCREMENTAL ADDITION TO PREVENT FOAMING, RANEY CATALYST STAUFFER CHEMICAL COMPANY (US) 1987-03-17 — — US disclosed
EP-0210683-A1 Promotion of raney nickel catalyst STAUFFER CHEMICAL COMPANY (US) 1987-02-04 — — EP disclosed
US-4613691-A Preparation of amino acids from unsaturated hydantoins STAUFFER CHEMICAL COMPANY (US) 1986-09-23 — — US disclosed
US-4582903-A Synthesis of unsaturated hydantoins with an inexpensive catalyst STAUFFER CHEMICAL COMPANY (US) 1986-04-15 — — US disclosed
EP-0177072-A2 Preparation of amino acids from unsaturated hydantoins STAUFFER CHEMICAL COMPANY (US) 1986-04-09 — — EP disclosed
US-4345072-A Process for the production of 5-arylidene hydantoins (B) DEGUSSA AG (DE) 1982-08-17 — — US disclosed
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