SCHEMBL9792252

SCHEMBL9792252

COC(=O)C(CCn1c(Cl)ccc1C(=O)c1ccc(OC)cc1)C(=O)OC

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.43
ALOX15 P16050 2/20 0.42
LMNA P02545 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
HTT P42858 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TAS1R3 Q7RTX0 1/20 0.40
TAS1R1 Q7RTX1 1/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
KMT2A Q03164 2/20 0.39
VNN1 O95497 2/20 0.39
MAPT P10636 2/20 0.38
RAB9A P51151 2/20 0.38
GSK3B P49841 1/20 0.38
MEN1 O00255 1/20 0.38
MAPK1 P28482 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
PTGS2 P35354 2/20 0.37

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
SCHEMBL9792191 0.90 HTT (0.41) HPGDLMNAHTTALDH1A1KMT2A
SCHEMBL9792203 0.88 KMT2A (0.40) HPGDLMNANPSR1HTTKMT2A
SCHEMBL9792312 0.85 TAS1R3 (0.41) ALDH1A1TAS1R3TAS1R1
SCHEMBL9792189 0.82 ELANE (0.34) HPGDLMNAALDH1A1TAS1R3TAS1R1
SCHEMBL9792234 0.81 HPGD (0.40) HPGDLMNAHTTALDH1A1KMT2A
SCHEMBL9792213 0.81 TAS1R3 (0.40) HPGDLMNANPSR1HTTALDH1A1
SCHEMBL9792318 0.79 HPGD (0.45) HPGDLMNANPSR1ALDH1A1KMT2A
SCHEMBL9792307 0.79 SMN1; SMN2 (0.40) HPGDALDH1A1KMT2AMAPTRAB9A
SCHEMBL9792210 0.78 KMT2A (0.34) HPGDALDH1A1KMT2AMAPTRAB9A
SCHEMBL11060324 0.78 HTT (0.37) HPGDLMNAHTTMAPTPTGS2

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