SCHEMBL3265199

SCHEMBL3265199

CCCCNCc1ccc(OC)c(F)c1

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.56
POLB P06746 1/20 0.56
S1PR2 O95136 2/20 0.56
S1PR1 P21453 2/20 0.56
S1PR3 Q99500 2/20 0.56
LPAR2 Q9HBW0 2/20 0.56
HTR1A P08908 1/20 0.55
HTR1D P28221 1/20 0.55
HTR2A P28223 1/20 0.55
HTR2C P28335 1/20 0.55
HTR7 P34969 1/20 0.55
HTR2B P41595 1/20 0.55
HTR5A P47898 1/20 0.55
HTR6 P50406 1/20 0.55
CARM1 Q86X55 1/20 0.49
PRMT6 Q96LA8 1/20 0.49
HTT P42858 1/20 0.48
RAB9A P51151 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL3269547 0.86 KDM4E (0.74) KDM4EPOLBS1PR2S1PR1S1PR3
SCHEMBL21534766 0.84 HTR1A (0.51) KDM4EPOLBHTR1AHTR1DHTR2A
SCHEMBL19049501 0.79 KDM4E (0.50) KDM4EHTT
SCHEMBL906529 0.79 KDM4E (0.60) KDM4EPOLB
SCHEMBL11222002 0.78 PPARG (0.54) KDM4EHTT
SCHEMBL23046575 0.77 KDM1A (0.52) KDM4EHTTRAB9A
SCHEMBL296365 0.77 HTR7 (0.58) POLBHTR1AHTR1DHTR2AHTR2C
SCHEMBL3269637 0.77 CHRM2 (0.54) POLBKMT2A
SCHEMBL8605990 0.77 S1PR2 (0.61) KDM4EPOLBS1PR2S1PR1S1PR3
SCHEMBL20565356 0.76 MEN1 (0.45) KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120004262-A1 PHENYLCYCLOPROPYLAMINE DERIVATIVES AND THEIR MEDICAL USE ORYZON GENOMICS, S.A. (ES) 2012-01-05 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-20120004262-A1 PHENYLCYCLOPROPYLAMINE DERIVATIVES AND THEIR MEDICAL USE PNMT, ABCB1, SNCA KDM4E 1015/4885POLB 1663/4885S1PR2 484/4885

“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.