SCHEMBL5611547

SCHEMBL5611547

Cc1cc(Br)c2c(c1)CC(C)C2

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 1/20 0.31
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
HTR2B P41595 1/20 0.30

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
SCHEMBL415656 0.79 DRD2 (0.37) ALDH1A1HTR2AHTR2CHTR2B
SCHEMBL29511500 0.79 DRD2 (0.37) ALDH1A1HTR2AHTR2CHTR2B
SCHEMBL16315956 0.78 PARP1 (0.31)
SCHEMBL19393517 0.78 FYN (0.38) HTR2AHTR2CHTR2B
SCHEMBL16315903 0.78 LMNA (0.33) KDM4EMEN1ALDH1A1KMT2AHTR2A
SCHEMBL21386525 0.76 NOTUM (0.32)
SCHEMBL20368612 0.76 ALDH1A1 (0.33) KDM4EALDH1A1
SCHEMBL15822204 0.76 CYP1A2 (0.36) ALDH1A1
SCHEMBL15822588 0.76 L3MBTL1 (0.33)
SCHEMBL20018388 0.72

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
EP-1833858-A2 HALOGEN SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION Exxonmobil Chemical Patents Inc. (US) 2007-09-19 EP disclosed
WO-2006065906-A2 HALOGEN SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-06-22 WO disclosed