SCHEMBL3787907

SCHEMBL3787907

Nc1cccc(-c2cccc(OCc3ccccc3)c2)c1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.81
APP P05067 1/20 0.59
MRGPRX4 Q96LA9 1/20 0.56
MAOA P21397 3/20 0.56
GAA P10253 1/20 0.56
MAPT P10636 1/20 0.56
RAB9A P51151 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
CYP4F2 P78329 1/20 0.53
CYP4A11 Q02928 1/20 0.53
BCHE P06276 1/20 0.53
NR4A2 P43354 2/20 0.52
PIK3CD O00329 1/20 0.51
PIK3CA P42336 1/20 0.51
PIK3CB P42338 1/20 0.51
PIK3CG P48736 1/20 0.51
PRKDC P78527 1/20 0.51
F9 P00740 1/20 0.51
F10 P00742 1/20 0.51

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
SCHEMBL3784976 0.90 MAOB (0.71) MAOBAPPMRGPRX4MAOAGAA
3-(Benzyloxy)Aniline SCHEMBL291445 0.90 MAOB (1.00) MAOBAPPMAOAGAAMAPT
3-(Benzyloxy)Aniline SCHEMBL29428912 0.90 MAOB (1.00) MAOBAPPMAOAGAAMAPT
SCHEMBL379281 0.89 MAOB (0.67) MAOBMRGPRX4MAOACYP4F2CYP4A11
SCHEMBL3786472 0.89 MAOB (0.68) MAOBAPPMRGPRX4MAOAGAA
SCHEMBL30426715 0.89 MAOB (0.68) MAOBAPPMRGPRX4MAOAGAA
SCHEMBL3791194 0.89 MAOB (0.68) MAOBAPPMAOAGAAMAPT
3-(Benzyloxy)Aniline SCHEMBL11263814 0.88 MAOB (0.96) MAOBAPPMAOAGAAMAPT
SCHEMBL2137838 0.88 MRGPRX4 (0.69) MAOBMRGPRX4MAOACYP4F2CYP4A11
SCHEMBL2869923 0.87 MAOB (0.81) MAOBAPPMRGPRX4MAOAGAA

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
US-11535597-B2 Photoreactive ligands and uses thereof THE SCRIPPS RESEARCH INSTITUTE (US) 2022-12-27 US disclosed
US-20200071277-A1 PHOTOREACTIVE LIGANDS AND USES THEREOF THE SCRIPPS RESEARCH INSTITUTE 2020-03-05 US disclosed
US-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-04-08 US disclosed
EP-1914221-A1 PROCESS FOR PRODUCING BIARYL COMPOUND Sumitomo Chemical Company, Limited (JP) 2008-04-23 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 (3 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-11535597-B2 Photoreactive ligands and uses thereof CLTB, CRYAB, CRYAA MAOB 2856/4885APP 2950/4885MRGPRX4 2052/4885
US-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND NISCH, BLVRB, BBOX1 MAOB 101/4885APP 2554/4885MRGPRX4 1464/4885
US-20200071277-A1 PHOTOREACTIVE LIGANDS AND USES THEREOF CLTB, CRYAB, CRYAA MAOB 2856/4885APP 2950/4885MRGPRX4 2052/4885

“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.