SCHEMBL8962145

SCHEMBL8962145

Cc1ccc(CCc2ccccc2)c2c1C=CC2

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
ABL1 P00519 1/20 0.33
RIN1 Q13671 1/20 0.33
HTR1A P08908 1/20 0.33
DRD2 P14416 1/20 0.33
ABCB1 P08183 1/20 0.32
KCNH2 Q12809 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
KMT2A Q03164 1/20 0.32
ATP4A P20648 1/20 0.31
ATP4B P51164 1/20 0.31

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
SCHEMBL7060105 0.80 HTR2C (0.31)
SCHEMBL8962330 0.75 TYR (0.41) PTGS1PTGS2KCNH2MEN1ALDH1A1
SCHEMBL7453975 0.74
SCHEMBL1826218 0.71 CYP1A2 (0.32)
SCHEMBL10864667 0.71 CYP1A2 (0.52) ABL1RIN1HTR1ADRD2KCNH2
SCHEMBL8962448 0.70 ESR2 (0.38) MAOAMAOB
SCHEMBL22228283 0.69 CYP1A2 (0.31)
SCHEMBL6349427 0.69
SCHEMBL6913096 0.67 HTR2C (0.33)
SCHEMBL27885784 0.66 NR1H3 (0.42) HTR1ADRD2ABCB1MAOBMEN1

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