SCHEMBL6408089

SCHEMBL6408089

COC(=O)C(Cc1ccc(-c2ccc(OC(F)(F)F)cc2)cc1)NC(=O)c1cc2ccccc2cc1O

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.53
CDK2 P24941 4/20 0.49
HDAC1 Q13547 6/20 0.49
HDAC6 Q9UBN7 6/20 0.49
TACR3 P29371 1/20 0.48
ELANE P08246 2/20 0.46
GAA P10253 1/20 0.45
RAB9A P51151 1/20 0.45
TSHR P16473 1/20 0.44
MDM4 O15151 1/20 0.44
MDM2 Q00987 1/20 0.44
FPR2 P25090 1/20 0.44
ALDH1A1 P00352 2/20 0.44
KDM4E B2RXH2 1/20 0.44
PKM P14618 1/20 0.44
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL6408091 1.00 KDR (0.53) KDRCDK2HDAC1HDAC6TACR3
SCHEMBL13986736 0.91 KDR (0.60) KDRCDK2HDAC1HDAC6TACR3
SCHEMBL4824091 0.91 KDR (0.60) KDRCDK2HDAC1HDAC6TACR3
SCHEMBL4824089 0.91 KDR (0.60) KDRCDK2HDAC1HDAC6TACR3
SCHEMBL6400300 0.90 KDR (0.56) KDRCDK2HDAC1HDAC6TACR3
SCHEMBL4829712 0.90 CDK2 (0.52) KDRCDK2HDAC1HDAC6TACR3
SCHEMBL4829718 0.90 CDK2 (0.52) KDRCDK2HDAC1HDAC6TACR3
SCHEMBL6400298 0.90 KDR (0.56) KDRCDK2HDAC1HDAC6TACR3
SCHEMBL4831835 0.90 FPR2 (0.56) FPR2
SCHEMBL4831843 0.90 FPR2 (0.56) FPR2

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-20050059713-A1 Aryl and heteroaryl compounds, compositions, and methods of use VTVX HOLDINGS I LLC 2005-03-17 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-20050059713-A1 Aryl and heteroaryl compounds, compositions, and methods of use CYP2F1, CYP3A43, PNPO KDR 1624/4885CDK2 456/4885HDAC1 1171/4885

“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.