SCHEMBL4411642

SCHEMBL4411642

COC(=O)c1ccc(N(c2ccc(C=Cc3ccncc3)cc2)c2ccc(C=Cc3ccncc3)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.54
HDAC1 Q13547 1/20 0.54
HDAC6 Q9UBN7 1/20 0.54
PTPN1 P18031 1/20 0.52
SNCA P37840 1/20 0.52
MAPT P10636 7/20 0.50
NPC1 O15118 5/20 0.50
RAB9A P51151 4/20 0.50
KMT2A Q03164 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
ALDH1A1 P00352 2/20 0.50
MEN1 O00255 2/20 0.50
ALOX15 P16050 1/20 0.50
CASP1 P29466 1/20 0.50
HBB P68871 1/20 0.50
KDM4E B2RXH2 3/20 0.49
LMNA P02545 3/20 0.47
HPGD P15428 2/20 0.46
CYP1A2 P05177 2/20 0.46
CYP2D6 P10635 2/20 0.46

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
SCHEMBL7981695 0.91 KDM1A (0.64) KDM1AHDAC1HDAC6PTPN1SNCA
SCHEMBL7975552 0.91 KDM1A (0.64) KDM1AHDAC1HDAC6PTPN1SNCA
SCHEMBL7975551 0.91 KDM1A (0.64) KDM1AHDAC1HDAC6PTPN1SNCA
SCHEMBL19076177 0.84 ALDH1A1 (0.56) KDM1AHDAC1HDAC6PTPN1SNCA
SCHEMBL3829376 0.81 KDM1A (0.56) KDM1AHDAC1HDAC6SNCAMAPT
SCHEMBL31301140 0.80 PTPN1 (0.73) PTPN1MAPTNPC1RAB9AKMT2A
SCHEMBL71401 0.80 PTPN1 (0.73) PTPN1MAPTNPC1RAB9AKMT2A
SCHEMBL2627847 0.80 PTPN1 (0.73) PTPN1MAPTNPC1RAB9AKMT2A
SCHEMBL71402 0.80 PTPN1 (0.73) PTPN1MAPTNPC1RAB9AKMT2A
SCHEMBL5379059 0.80 PTPN1 (0.73) PTPN1MAPTNPC1RAB9AKMT2A

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-8664400-B2 Triphenylamine derivatives useful as fluorophores in biology, in particular for two-photon microscopy CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2014-03-04 US claimed
US-20090314990-A1 NOVEL TRIPHENYLAMINE DERIVATIVES USEFUL AS FLUOROPHORES IN BIOLOGY, IN PARTICULAR FOR TWO-PHOTON MICROSCOPY CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2009-12-24 US claimed
US-8664400-B2 Triphenylamine derivatives useful as fluorophores in biology, in particular for two-photon microscopy CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2014-03-04 US disclosed
US-20090314990-A1 NOVEL TRIPHENYLAMINE DERIVATIVES USEFUL AS FLUOROPHORES IN BIOLOGY, IN PARTICULAR FOR TWO-PHOTON MICROSCOPY CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2009-12-24 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-20090314990-A1 NOVEL TRIPHENYLAMINE DERIVATIVES USEFUL AS FLUOROPHORES IN BIOLOGY, IN PARTICULAR FOR TWO-PHOTON MICROSCOPY TERB1, TRDMT1, TARBP1 KDM1A 4129/4885HDAC1 3732/4885HDAC6 2165/4885

“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.