SCHEMBL27435699

SCHEMBL27435699

COC(=O)C(Cc1ccccc1)NCCN

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.58
THRB P10828 1/20 0.58
CYP2C9 P11712 1/20 0.58
CYP2C19 P33261 1/20 0.58
HSD17B10 Q99714 1/20 0.58
POLB P06746 2/20 0.57
ATM Q13315 2/20 0.56
ANPEP P15144 2/20 0.53
KMT2A Q03164 2/20 0.52
CA12 O43570 2/20 0.51
CA2 P00918 2/20 0.51
CA9 Q16790 2/20 0.51
CA7 P43166 1/20 0.51
CA14 Q9ULX7 1/20 0.51
LMNA P02545 1/20 0.51
GLA P06280 1/20 0.51
TSHR P16473 1/20 0.50
MEN1 O00255 1/20 0.50
ITGA4 P13612 1/20 0.50
ITGB7 P26010 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
SCHEMBL6936702 1.00 ALDH1A1 (0.58) ALDH1A1THRBCYP2C9CYP2C19HSD17B10
SCHEMBL12197317 0.88 POLB (0.59) ALDH1A1THRBCYP2C9CYP2C19HSD17B10
SCHEMBL7392765 0.86 POLB (0.70) ALDH1A1THRBCYP2C9CYP2C19HSD17B10
SCHEMBL12197316 0.86 POLB (0.58) ALDH1A1THRBCYP2C9CYP2C19HSD17B10
SCHEMBL12534426 0.86 ALDH1A1 (0.59) ALDH1A1THRBCYP2C9CYP2C19HSD17B10
SCHEMBL9003236 0.86 POLB (0.70) ALDH1A1THRBCYP2C9CYP2C19HSD17B10
SCHEMBL5158344 0.84 MME (0.51) L3MBTL1
SCHEMBL6821732 0.84 ALDH1A1 (0.57) ALDH1A1THRBCYP2C9CYP2C19HSD17B10
SCHEMBL4024431 0.84 POLB (0.63) ALDH1A1THRBCYP2C9CYP2C19HSD17B10
SCHEMBL3959739 0.83 ATM (0.68) ALDH1A1THRBCYP2C9CYP2C19HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1127488-C Compounds with growth hormone releasing properties NOVO NORDISK AS (DK) 2003-11-12 CN disclosed
CN-1216537-A Compounds with growth hormone releasing properties NOVO NORDISK AS (DK) 1999-05-12 CN disclosed