SCHEMBL10154136

SCHEMBL10154136

c1ccc(N(c2ccccc2)c2ccccc2-c2ccccc2P(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
DRD1 P21728 2/20 0.36
ALDH1A1 P00352 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
ESR1 P03372 2/20 0.31
ESR2 Q92731 2/20 0.31
KDM4E B2RXH2 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
MAPT P10636 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
MEN1 O00255 1/20 0.31
CRHBP P24387 1/20 0.31
KMT2A Q03164 1/20 0.31
ATM Q13315 1/20 0.31
CRHR2 Q13324 1/20 0.31
TLR9 Q9NR96 1/20 0.31
KCNA3 P22001 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
SCHEMBL2850107 0.81 TDP1 (0.44) CYP3A4TDP1DRD1ALDH1A1L3MBTL1
SCHEMBL1120987 0.80 CYP3A4 (0.58) CYP3A4TDP1DRD1ESR1ESR2
SCHEMBL5149203 0.80 ALDH1A1 (0.44) CYP3A4TDP1DRD1ALDH1A1L3MBTL1
SCHEMBL229536 0.80 ALDH1A1 (0.41) CYP3A4TDP1DRD1ALDH1A1L3MBTL1
SCHEMBL29444117 0.80 ALDH1A1 (0.41) CYP3A4TDP1DRD1ALDH1A1L3MBTL1
SCHEMBL29822698 0.80 ALDH1A1 (0.41) CYP3A4TDP1DRD1ALDH1A1L3MBTL1
Water SCHEMBL1131329 0.78 CYP3A4 (0.55) CYP3A4TDP1DRD1ESR1ESR2
SCHEMBL12853968 0.78 ALDH1A1 (0.42) CYP3A4TDP1DRD1ALDH1A1L3MBTL1
SCHEMBL31059891 0.78 CYP3A4 (0.55) CYP3A4TDP1DRD1ESR1ESR2
Water SCHEMBL1131752 0.78 CYP3A4 (0.55) CYP3A4TDP1DRD1ESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110818717-A Organic electroluminescent device and condensed cyclic compound for organic electroluminescent device 三星显示有限公司 2020-02-21 CN disclosed
EP-2423192-A1 METAL COMPLEX HAVING AROMATIC LIGAND THAT CONTAINS NITROGEN ATOM Sumitomo Chemical Company, Limited (JP) 2012-02-29 EP disclosed
US-20120041203-A1 METAL COMPLEX HAVING AROMATIC RING LIGAND CONTAINING NITROGEN ATOM SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-02-16 US disclosed
US-20120041203-A1 METAL COMPLEX HAVING AROMATIC RING LIGAND CONTAINING NITROGEN ATOM SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-02-16 US disclosed
US-20110309304-A1 LUMINESCENT SILVER COMPLEX SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-12-22 US disclosed
US-20110309304-A1 LUMINESCENT SILVER COMPLEX SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-12-22 US disclosed
EP-2360162-A1 LUMINESCENT SILVER COMPLEXES Sumitomo Chemical Company, Limited (JP) 2011-08-24 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120041203-A1 METAL COMPLEX HAVING AROMATIC RING LIGAND CONTAINING NITROGEN ATOM MICA, CD4, CLTC CYP3A4 4299/4885TDP1 4839/4885DRD1 2931/4885
US-20110309304-A1 LUMINESCENT SILVER COMPLEX SOD1, AS3MT, GLO1 CYP3A4 2373/4885TDP1 3224/4885DRD1 3126/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.