SCHEMBL120941

SCHEMBL120941

Cc1cc2cc(Cl)c(C)cc2cc1Cl

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CD44 P16070 1/20 0.52
GRIN2D O15399 1/20 0.42
GRIN3B O60391 1/20 0.42
GRIN1 Q05586 1/20 0.42
GRIN2A Q12879 1/20 0.42
GRIN2B Q13224 1/20 0.42
GRIN2C Q14957 1/20 0.42
GRIN3A Q8TCU5 1/20 0.42
CYP3A4 P08684 2/20 0.42
LMNA P02545 1/20 0.41
PDE3B Q13370 1/20 0.38
PDE3A Q14432 1/20 0.38
CHRM1 P11229 1/20 0.35
ALOX15 P16050 1/20 0.35
MAOA P21397 1/20 0.35
TBXA2R P21731 1/20 0.35
ADRA1A P35348 1/20 0.35
HTR2B P41595 1/20 0.35
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL12927901 1.00 CD44 (0.52) CD44GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL811040 0.87 CD44 (0.39) CD44GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL28220939 0.84 MAPT (0.42) CD44CYP3A4ALOX15ALDH1A1GAA
SCHEMBL811102 0.84 AHR (0.40) CD44GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL1755224 0.83 MAPT (0.45) CD44CYP3A4LMNAALDH1A1GAA
SCHEMBL20802473 0.83 CYP1A2 (0.59) CD44CYP3A4LMNAALDH1A1KDM4E
SCHEMBL21507502 0.83 CYP1A2 (0.59) CD44CYP3A4LMNAALDH1A1KDM4E
SCHEMBL120848 0.82 CD44 (0.61) CD44GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL28452535 0.81 CD44 (0.42) CD44GRIN2DGRIN3BGRIN1GRIN2A
Ammonia Solution, Strong SCHEMBL27937844 0.81 MAPT (0.44) CD44CYP3A4LMNAALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8895963-B2 Organic semiconductor material, organic semiconductor thin film, and organic thin-film transistor DAINICHISEIKA COLOR & CHEMICALS MFG. CO., LTD. (JP) 2014-11-25 US disclosed
US-8895963-B2 Organic semiconductor material, organic semiconductor thin film, and organic thin-film transistor DAINICHISEIKA COLOR & CHEMICALS MFG. CO., LTD. (JP) 2014-11-25 US disclosed
EP-2430678-B1 ORGANIC SEMICONDUCTOR MATERIAL, ORGANIC SEMICONDUCTOR THIN FILM, AND ORGANIC THIN-FILM TRANSISTOR DAINICHISEIKA COLOR CHEM (JP) 2014-01-01 EP disclosed
US-20120056166-A1 Organic semiconductor material, organic semiconductor thin film, and organic thin-film transistor DAINICHISEIKA COLOR & CHEMICALS MFG. CO., LTD. (JP) 2012-03-08 US disclosed
US-20120056166-A1 Organic semiconductor material, organic semiconductor thin film, and organic thin-film transistor DAINICHISEIKA COLOR & CHEMICALS MFG. CO., LTD. (JP) 2012-03-08 US disclosed
WO-2010131764-A1 ORGANIC SEMICONDUCTOR MATERIAL, ORGANIC SEMICONDUCTOR THIN FILM, AND ORGANIC THIN-FILM TRANSISTOR DAINICHISEIKA COLOR & CHEMICALS MFG. CO., LTD. (JP) 2010-11-18 WO 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 (1 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-20120056166-A1 Organic semiconductor material, organic semiconductor thin film, and organic thin-film transistor SLCO2A1, SOST, SLCO1A2 CD44 490/4885GRIN2D 749/4885GRIN3B 2156/4885

“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.