SCHEMBL709040

SCHEMBL709040

c1ccc(N(c2ccccc2)c2ccc(-c3ccc(-c4ccnc(CNc5ccc6ccccc6c5)n4)cc3)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
HIF1A Q16665 1/20 0.38
HSD17B10 Q99714 1/20 0.38
DKK1 O94907 1/20 0.36
GSK3B P49841 1/20 0.36
INSR P06213 1/20 0.36
IGF1R P08069 1/20 0.36
MRGPRX4 Q96LA9 1/20 0.36
NPC1 O15118 1/20 0.36
MEN1 O00255 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
SREBF2 Q12772 1/20 0.35
CYP11B1 P15538 1/20 0.35
SYK P43405 1/20 0.34

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
SCHEMBL710577 0.89 SREBF2 (0.38) CYP2C9ALDH1A1CYP1A2CYP3A4CYP2D6
SCHEMBL710948 0.88 MAOA (0.38) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL710336 0.80 SYK (0.55) DKK1GSK3BSYKIKBKBCAMK2D
SCHEMBL10019586 0.72 DYRK1A (0.41) DKK1GSK3BMEN1HTTKMT2A
SCHEMBL12955830 0.70 ALDH1A1 (0.62) CYP2C9ALDH1A1CYP1A2CYP3A4CYP2D6
SCHEMBL709831 0.70 IKBKB (0.59) GSK3BIKBKBHDAC1HDAC6CAMK2D
SCHEMBL708351 0.69 DYRK1A (0.48) CYP1A2GSK3BMEN1KMT2AIKBKB
SCHEMBL12956012 0.69 ALDH1A1 (0.65) CYP2C9ALDH1A1CYP1A2CYP3A4CYP2D6
SCHEMBL710850 0.69 CAMK2D (0.63) GSK3BNPC1IKBKBHDAC1HDAC6
SCHEMBL24177541 0.68 ESR1 (0.45) CYP2C9ALDH1A1CYP1A2CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8124762-B2 Diphenyl amine derivatives having luminescence property KOREA INSTITUTE OF SCIENCE & TECHNOLOGY (KR) 2012-02-28 US disclosed
US-20100063281-A1 DIPHENYL AMINE DERIVATIVES HAVING LUMINESCENCE PROPERTY KOREA INSTITUTE OF SCIENCE & TECHNOLOGY (KR) 2010-03-11 US 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-20100063281-A1 DIPHENYL AMINE DERIVATIVES HAVING LUMINESCENCE PROPERTY TYR, PNMT, DDC CYP2C9 604/4885ALDH1A1 94/4885CYP1A2 625/4885

“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.