SCHEMBL20976451

SCHEMBL20976451

COc1ccc(C(F)(F)F)cc1NC(=O)N[C@H]1CC[C@H](Oc2ccncc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 12/20 0.56
▸ TEAD1 P28347 1/20 0.49
▸ MEN1 O00255 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ RAF1 P04049 8/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ FAAH O00519 2/20 0.46
▸ BRAF P15056 1/20 0.44

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
SCHEMBL20357201 0.88 EPHX2 (0.62) EPHX2RAF1FAAH
SCHEMBL18615522 0.88 EPHX2 (0.62) EPHX2RAF1FAAH
SCHEMBL20357297 0.86 MEN1 (0.47) EPHX2MEN1KMT2ARAF1KDM4E
SCHEMBL18615448 0.86 MEN1 (0.47) EPHX2MEN1KMT2ARAF1KDM4E
SCHEMBL20357351 0.86 KDR (0.46) EPHX2MEN1KMT2ARAF1KDM4E
SCHEMBL18615495 0.86 KDR (0.46) EPHX2MEN1KMT2ARAF1KDM4E
SCHEMBL20976430 0.83 RAF1 (0.47) EPHX2RAF1LMNABRAF
SCHEMBL18615451 0.81 MEN1 (0.69) EPHX2MEN1KMT2AKDM4EALDH1A1
SCHEMBL20357355 0.81 KDR (0.45) MEN1KMT2ARAF1KDM4EALDH1A1
SCHEMBL18615652 0.81 KDR (0.45) MEN1KMT2ARAF1KDM4EALDH1A1

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-10280145-B2 Urea derivative and use therefor TORAY INDUSTRIES, INC. (JP) 2019-05-07 — — 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-10280145-B2 Urea derivative and use therefor UTS2R, DDR1, WEE1 EPHX2 4826/4885TEAD1 1567/4885MEN1 603/4885

“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.

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