SCHEMBL5370698

SCHEMBL5370698

N#Cc1cc(Cc2cccc(Cl)c2)ccc1N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.44
PNMT P11086 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HSD17B10 Q99714 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
HTR3E A5X5Y0 2/20 0.42
HTR3B O95264 2/20 0.42
HTR3A P46098 2/20 0.42
HTR3D Q70Z44 2/20 0.42
HTR3C Q8WXA8 2/20 0.42
TAAR1 Q96RJ0 3/20 0.42
IDO1 P14902 2/20 0.41
AGXT P21549 2/20 0.41
NPSR1 Q6W5P4 1/20 0.40
PRKACA P17612 1/20 0.40

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
SCHEMBL5360561 0.85 CYP3A4 (0.48) CYP3A4MEN1KMT2AKDM4EALDH1A1
SCHEMBL11057646 0.85 CYP3A4 (0.48) CYP3A4MEN1KMT2AKDM4EALDH1A1
SCHEMBL5360516 0.83 IDH1 (0.43) CYP3A4MEN1KMT2AKDM4EALDH1A1
SCHEMBL5351161 0.81 CYP3A4 (0.56) CYP3A4PNMTMEN1KMT2AKDM4E
SCHEMBL5351272 0.78 LTA4H (0.48) ALDH1A1HTTTAAR1IDO1AGXT
SCHEMBL5360422 0.77 CYP3A4 (0.43) CYP3A4PNMTKDM4EALDH1A1HTT
SCHEMBL5414685 0.76 CA1 (0.45) CYP3A4MEN1KMT2AKDM4EALDH1A1
SCHEMBL11067117 0.76 KMT2A (0.48) CYP3A4MEN1KMT2AKDM4EALDH1A1
SCHEMBL11067120 0.76 KMT2A (0.48) CYP3A4MEN1KMT2AKDM4EALDH1A1
SCHEMBL4168666 0.76 KDM4E (0.55) KDM4EALDH1A1TAAR1PRKACAPRKACG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7256197-B2 Methods for synthesis of diarylmethanes DANA-FARBER CANCER INSTITUTE (US) 2007-08-14 US disclosed
US-20040267011-A1 Methods for synthesis of diarylmethanes DANA-FARBER CANCER INSTITUTE 2004-12-30 US disclosed
WO-2003031458-A1 METHODS FOR SYNTHESIS OF DIARYLMETHANES DANA-FARBER CANCER INSTITUTE (US) 2003-04-17 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-20040267011-A1 Methods for synthesis of diarylmethanes DHFR, DPYD, DHODH CYP3A4 92/4885PNMT 300/4885MEN1 1597/4885

“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.