SCHEMBL9792216

SCHEMBL9792216

COc1ccc(C(=O)c2ccc(Cl)[nH]2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.59
▸ KMT2A Q03164 3/20 0.51
▸ MAPT P10636 3/20 0.50
▸ RAB9A P51151 2/20 0.50
▸ MEN1 O00255 2/20 0.50
▸ LMNA P02545 2/20 0.50
▸ MAPK1 P28482 2/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50
▸ RXFP1 Q9HBX9 1/20 0.50
▸ CES2 O00748 1/20 0.48
▸ CES1 P23141 1/20 0.48
▸ CA1 P00915 4/20 0.47
▸ CA2 P00918 4/20 0.47
▸ ALDH1A1 P00352 2/20 0.46
▸ GAA P10253 1/20 0.46
▸ PARP1 P09874 1/20 0.46
▸ PARP10 Q53GL7 1/20 0.46
▸ PARP2 Q9UGN5 1/20 0.46
▸ PARP4 Q9UKK3 1/20 0.46
▸ NPC1 O15118 1/20 0.45

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
SCHEMBL9792211 0.80 SRD5A2 (0.50) HPGDKMT2ARAB9AMEN1MAPK1
SCHEMBL11859212 0.78 HPGD (0.56) HPGDKMT2AMAPTRAB9AMEN1
SCHEMBL9792295 0.77 MEN1 (0.50) KMT2ARAB9AMEN1CES2CES1
SCHEMBL7676938 0.76 MAPT (0.52) HPGDKMT2AMAPTRAB9AMEN1
SCHEMBL51509 0.75 RXFP1 (0.79) HPGDKMT2AMAPTRAB9AMEN1
SCHEMBL9418310 0.75 RXFP1 (0.79) HPGDKMT2AMAPTRAB9AMEN1
SCHEMBL11813331 0.75 CA1 (0.49) HPGDKMT2AMAPTRAB9AMEN1
SCHEMBL2466074 0.74 HPGD (1.00) HPGDKMT2AMAPTRAB9AMEN1
SCHEMBL9792275 0.73 ALDH1A1 (0.37) KMT2ARAB9AMEN1MAPK1ALDH1A1
SCHEMBL7685125 0.73 RAB9A (0.53) HPGDKMT2AMAPTRAB9AMEN1

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
US-4988822-A Intermediates for preparing 5-aroyl-1,2-dihydro-3H-pyrrolo(1,2-A)pyrrole-1,1-dicarboxylates SYNTEX (U.S.A.) INC. (US) 1991-01-29 — — US disclosed
US-4873340-A Process for preparing 5-aroyl-1,2-dihydro-3H-pyrrolo[1,2-A]pyrrole-1,1-dicarboxylates SYNTEX (U.S.A.) INC. (US) 1989-10-10 — — US disclosed
Send feedback