SCHEMBL27366263

SCHEMBL27366263

CCc1[nH]c2ccc(C)cc2c1COC(C)=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.52
KDM4E B2RXH2 6/20 0.52
HSD17B10 Q99714 4/20 0.52
KMT2A Q03164 5/20 0.48
MAPT P10636 4/20 0.48
MEN1 O00255 4/20 0.48
GAA P10253 3/20 0.48
SMN1; SMN2 Q16637 4/20 0.47
RAB9A P51151 2/20 0.47
NPC1 O15118 1/20 0.47
TP53 P04637 1/20 0.47
EGFR P00533 2/20 0.43
RECQL P46063 1/20 0.43
TSHR P16473 2/20 0.43
CDK2 P24941 1/20 0.42
SIRT1 Q96EB6 1/20 0.41
ATM Q13315 2/20 0.41
LMNA P02545 1/20 0.41
PABPC1 P11940 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL8300492 0.78 KDM4E (0.51) ALDH1A1KDM4EHSD17B10KMT2AMAPT
SCHEMBL18404931 0.75 HSD17B10 (0.59) ALDH1A1KDM4EHSD17B10KMT2AMAPT
SCHEMBL28684373 0.73 ALDH1A1 (0.46) ALDH1A1KDM4EKMT2AMAPTMEN1
SCHEMBL16943501 0.72 ALDH1A1 (0.71) ALDH1A1KDM4EHSD17B10KMT2AMAPT
SCHEMBL27939080 0.71 ALDH1A1 (0.46) ALDH1A1KDM4EHSD17B10KMT2AMAPT
SCHEMBL27459777 0.71 ADRA2A (0.53) ALDH1A1KDM4EHSD17B10KMT2AMAPT
SCHEMBL26646738 0.71 MAPT (0.53) ALDH1A1KDM4EHSD17B10KMT2AMAPT
SCHEMBL26227993 0.70 HSD17B10 (0.56) ALDH1A1KDM4EHSD17B10KMT2AMAPT
SCHEMBL3107611 0.70 PRNP (0.71) ALDH1A1KDM4EHSD17B10KMT2AMAPT
SCHEMBL19193144 0.70 HTR7 (0.53) HSD17B10KMT2AMEN1GAASIRT1

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-1067986-C 1H-indole-3-acetic acid hydrazide spla2 inhibitors LILLY CO ELI (US) 2001-07-04 CN disclosed
CN-1098714-A The 1H-indole-3-acetic acid hydrazide spla 2 inhibitors LILLY CO ELI (US) 1995-02-15 CN disclosed