SCHEMBL9858330

SCHEMBL9858330

COC(=O)C1(C(=O)c2ccccc2)C=CC=CC1c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.38
ALDH1A1 P00352 5/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.38
KMT2A Q03164 4/20 0.38
POLB P06746 2/20 0.38
LMNA P02545 1/20 0.38
CYP3A4 P08684 4/20 0.38
MEN1 O00255 3/20 0.38
HTT P42858 1/20 0.35
MAPT P10636 7/20 0.35
KDM4E B2RXH2 1/20 0.35
RECQL P46063 1/20 0.35
CES2 O00748 1/20 0.34
CES1 P23141 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
SCHEMBL9851147 0.79 NPC1 (0.37) ALDH1A1SMN1; SMN2KMT2APOLBLMNA
SCHEMBL505429 0.77 EDNRA (0.32) TSHRHSD17B10POLBCYP3A4MAPT
SCHEMBL7174116 0.77
SCHEMBL5170532 0.72 POLB (0.35) TSHRHSD17B10KMT2APOLBCYP3A4
SCHEMBL8858048 0.70 CYP2C19 (0.46) ALDH1A1ALOX15HSD17B10KMT2ACYP3A4
SCHEMBL8585800 0.68 ELANE (0.32) TSHRPOLB
SCHEMBL6898843 0.67
SCHEMBL28350465 0.67 TSHR (0.37) TSHRALDH1A1SMN1; SMN2ALOX15HSD17B10
SCHEMBL29289979 0.67 HSD11B1 (0.36) TSHRALDH1A1KMT2APOLBCYP3A4
SCHEMBL7801403 0.66 TSHR (0.36) TSHRALDH1A1SMN1; SMN2ALOX15HSD17B10

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
EP-0407808-A2 Catalyst, process for preparation of same, and process for polymerization of olefins using same SHOWA DENKO KABUSHIKI KAISHA (JP) 1991-01-16 EP disclosed