SCHEMBL11644206

SCHEMBL11644206

CCCOc1cc(-c2cc3ccccc3[nH]2)ccc1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHEK1 O14757 1/20 0.49
▸ FGFR1 P11362 1/20 0.49
▸ CDK4 P11802 1/20 0.49
▸ CCNA2 P20248 1/20 0.49
▸ CCND1 P24385 1/20 0.49
▸ CDK2 P24941 1/20 0.49
▸ CCND3 P30281 1/20 0.49
▸ KDR P35968 1/20 0.49
▸ KDM4E B2RXH2 5/20 0.49
▸ MAPT P10636 5/20 0.49
▸ KMT2A Q03164 4/20 0.49
▸ MEN1 O00255 3/20 0.49
▸ ALDH1A1 P00352 3/20 0.49
▸ HPGD P15428 3/20 0.49
▸ ALOX15 P16050 2/20 0.49
▸ USP2 O75604 1/20 0.49
▸ LMNA P02545 1/20 0.49
▸ POLB P06746 1/20 0.49
▸ GAA P10253 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49

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
SCHEMBL11643550 0.94 KDM4E (0.50) CHEK1FGFR1CDK4CCNA2CCND1
SCHEMBL11640758 0.91 ALOX15 (0.52) CHEK1FGFR1CDK4CCNA2CCND1
SCHEMBL11654467 0.85 RAB9A (0.55) CHEK1FGFR1CDK4CCNA2CCND1
SCHEMBL11411064 0.82 CDK4 (0.67) CHEK1FGFR1CDK4CCNA2CCND1
SCHEMBL11641323 0.82 NPC1 (0.49) CHEK1FGFR1CDK4CCNA2CCND1
SCHEMBL11644549 0.82 CHEK1 (0.47) CHEK1FGFR1CDK4CCNA2CCND1
SCHEMBL11645637 0.81 CHEK1 (0.46) CHEK1FGFR1CDK4CCNA2CCND1
SCHEMBL11648910 0.80 ALOX15 (0.46) CDK4CCND1KDM4EMAPTKMT2A
SCHEMBL11643641 0.79 KDM4E (0.51) CHEK1FGFR1CDK4CCNA2CCND1
SCHEMBL11659567 0.79 RAB9A (0.57) CHEK1FGFR1CDK4CCNA2CCND1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4129572-A TO STABILIZE POLYMERS USED IN FOOD PACKAGING INDUSTRY LABAZ (FR) 1978-12-12 — — US disclosed
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