SCHEMBL9230491

SCHEMBL9230491

CCC1(C)c2ccccc2N(C)C12C=Nc1c(OC)cc(OC)cc1O2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.52
THRB P10828 5/20 0.52
TDP1 Q9NUW8 5/20 0.52
KDM4E B2RXH2 4/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
LMNA P02545 4/20 0.52
L3MBTL1 Q9Y468 4/20 0.52
GAA P10253 4/20 0.52
RECQL P46063 3/20 0.52
ALDH1A1 P00352 2/20 0.52
HPGD P15428 2/20 0.52
HTT P42858 2/20 0.52
ALOX12 P18054 2/20 0.52
POLB P06746 1/20 0.52
MAPK1 P28482 1/20 0.52
PKM P14618 2/20 0.44
NPSR1 Q6W5P4 4/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43

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
SCHEMBL9840832 0.85 KDM4E (0.40) MAPTTHRBTDP1KDM4ESMN1; SMN2
SCHEMBL9325800 0.83 KDM4E (0.37) MAPTTHRBTDP1KDM4ESMN1; SMN2
SCHEMBL5345117 0.82 MAPT (0.79) MAPTTHRBTDP1KDM4ESMN1; SMN2
SCHEMBL9323992 0.81 MAPT (0.52) MAPTTHRBTDP1KDM4ESMN1; SMN2
SCHEMBL9614654 0.80 MAPT (0.40) MAPTTHRBTDP1KDM4ESMN1; SMN2
SCHEMBL9224085 0.80 MAPT (0.50) MAPTTHRBTDP1KDM4ESMN1; SMN2
SCHEMBL9226446 0.79 MAPT (0.58) MAPTTHRBTDP1KDM4ESMN1; SMN2
SCHEMBL9745987 0.78 MAPT (0.35) MAPTTHRBTDP1KDM4ESMN1; SMN2
SCHEMBL10428638 0.77 MAPT (0.51) MAPTTHRBTDP1KDM4ESMN1; SMN2
SCHEMBL29565466 0.76 MAPT (0.48) MAPTTHRBTDP1KDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0324786-B1 PHOTOCHROMIC SPIRO(INDOLINE) BENZOXAZINES AND ARTICLES CONTAINING THE SAME PPG INDUSTRIES INC (US) 1995-08-02 EP claimed
EP-0324786-A1 PHOTOCHROMIC SPIRO(INDOLINE) BENZOXAZINES AND ARTICLES CONTAINING THE SAME. PPG INDUSTRIES INC (US) 1989-07-26 EP claimed
EP-0324786-A4 PHOTOCHROMIC SPIRO(INDOLINE) BENZOXAZINES AND ARTICLES CONTAINING THE SAME. PPG INDUSTRIES INC (US) 1989-06-26 EP claimed
WO-1988002371-A1 PHOTOCHROMIC SPIRO(INDOLINE) BENZOXAZINES AND ARTICLES CONTAINING THE SAME PPG INDUSTRIES, INC. (US) 1988-04-07 WO claimed