SCHEMBL9792306

SCHEMBL9792306

O=C(c1ccc(Cl)[nH]1)c1ccc(Cl)cc1Cl

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.52
▸ TSHR P16473 1/20 0.52
▸ CASP1 P29466 1/20 0.52
▸ SRD5A2 P31213 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ MEN1 O00255 3/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ HIF1A Q16665 1/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ MAPT P10636 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.45
▸ ERCC5 P28715 1/20 0.42
▸ FEN1 P39748 1/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ POLB P06746 2/20 0.42
▸ CYP2C9 P11712 1/20 0.42

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
SCHEMBL195020 0.79 SMN1; SMN2 (0.71) SMN1; SMN2TSHRCASP1SRD5A2HTT
SCHEMBL30185351 0.79 SMN1; SMN2 (0.71) SMN1; SMN2TSHRCASP1SRD5A2HTT
SCHEMBL7685508 0.79 L3MBTL1 (0.52) SMN1; SMN2TSHRCASP1SRD5A2HTT
SCHEMBL6168778 0.77 ALOX15 (0.59) SMN1; SMN2TSHRCASP1SRD5A2HTT
SCHEMBL7682468 0.76 HTT (0.42) SMN1; SMN2TSHRCASP1SRD5A2HTT
SCHEMBL9653610 0.75 MAPT (0.56) SMN1; SMN2TSHRCASP1SRD5A2HTT
SCHEMBL11811167 0.74 MAPT (0.49) HTTMEN1KMT2AALDH1A1MAPK1
SCHEMBL9792211 0.74 SRD5A2 (0.50) SMN1; SMN2TSHRSRD5A2HTTMEN1
SCHEMBL11817628 0.73 RAB9A (0.42) SMN1; SMN2TSHRCASP1SRD5A2HTT
SCHEMBL9496067 0.72 SRD5A2 (0.79) SMN1; SMN2TSHRCASP1SRD5A2HTT

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
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