SCHEMBL8962211

SCHEMBL8962211

C1=Cc2c(c(-c3ccccc3)cc(-c3ccccc3)c2-c2ccco2)C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.40
KMT2A Q03164 6/20 0.40
ALDH1A1 P00352 5/20 0.40
HSD17B10 Q99714 5/20 0.40
KDM4E B2RXH2 5/20 0.40
HPGD P15428 4/20 0.40
BLM P54132 3/20 0.40
USP2 O75604 2/20 0.40
POLB P06746 2/20 0.40
CASP1 P29466 2/20 0.40
ESR1 P03372 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
ALOX15 P16050 1/20 0.40
MAPK1 P28482 1/20 0.40
CASP7 P55210 1/20 0.40
SMARCA2 P51531 1/20 0.40
PBRM1 Q86U86 1/20 0.40
PIK3R1 P27986 2/20 0.37
PIK3CA P42336 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
SCHEMBL8962344 0.72 HTR1A (0.35) MEN1KMT2AALDH1A1HSD17B10KDM4E
SCHEMBL7756242 0.68 PARP10 (0.33) ALDH1A1HSD17B10HPGDMAPK1ALOX5
SCHEMBL8962241 0.68 GAA (0.36) MEN1KMT2AALDH1A1HSD17B10KDM4E
SCHEMBL2966766 0.68 PIK3R1 (0.35) MEN1KMT2AALDH1A1HSD17B10KDM4E
SCHEMBL2967447 0.65 PIK3R1 (0.35) MEN1KMT2AALDH1A1HSD17B10KDM4E
SCHEMBL2973597 0.65 MAOA (0.35) ALDH1A1MAPK1
SCHEMBL2969646 0.65 ALDH1A1 (0.36) MEN1KMT2AALDH1A1HSD17B10KDM4E
SCHEMBL29755699 0.64 KDM4E (0.51) MEN1KMT2AALDH1A1HSD17B10KDM4E
SCHEMBL7116127 0.64 KDM4E (0.51) MEN1KMT2AALDH1A1HSD17B10KDM4E
SCHEMBL22411732 0.64 NLRP3 (0.36) MEN1KMT2AALDH1A1HSD17B10HPGD

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0500005-B1 Process for the preparation of substituted indenes HOECHST AG (DE) 1996-02-07 EP disclosed
US-5194619-A PROCESS FOR THE PREPARATION OF SUBSTITUTED INDENES HOECHST AKTIENGESELLSCHAFT (DE) 1993-03-16 US disclosed
EP-0500005-A1 Process for the preparation of substituted indenes HOECHST AKTIENGESELLSCHAFT (DE) 1992-08-26 EP disclosed