SCHEMBL18615487

SCHEMBL18615487

COc1c(CO)cc(C(F)(F)F)cc1NC(=O)NC1CCCCC1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 1/20 0.49
▸ EPHX2 P34913 3/20 0.48
▸ KMT2A Q03164 3/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ NPC1 O15118 4/20 0.44
▸ RAB9A P51151 4/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ GAA P10253 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ EPHX1 P07099 1/20 0.44
▸ POLB P06746 2/20 0.43
▸ HTT P42858 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
SCHEMBL18615479 0.85 EPHX2 (0.53) EPHX2KMT2AMEN1NPC1RAB9A
SCHEMBL18615444 0.85 KMT2A (0.47) MAPK14EPHX2KMT2AMEN1NPC1
SCHEMBL20365336 0.84 EPHX2 (0.52) EPHX2KMT2AMEN1NPC1RAB9A
SCHEMBL18615489 0.83 MAPK14 (0.44) MAPK14EPHX2KDM4EPOLB
SCHEMBL20357294 0.83 MAPK14 (0.44) MAPK14EPHX2KDM4EPOLB
SCHEMBL20976434 0.83 KMT2A (0.47) EPHX2KMT2AMEN1NPC1RAB9A
SCHEMBL18615611 0.81 MAPK14 (0.43) MAPK14EPHX2KMT2AGAAKDM4E
SCHEMBL20357312 0.81 MAPK14 (0.43) MAPK14EPHX2KMT2AGAAKDM4E
SCHEMBL20357281 0.79 MAPK14 (0.42) MAPK14EPHX2
SCHEMBL18615639 0.79 MAPK14 (0.42) MAPK14EPHX2

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
EP-3345893-B1 UREA DERIVATIVE AND USE THEREFOR TORAY INDUSTRIES (JP) 2019-10-30 — — EP disclosed
US-10280145-B2 Urea derivative and use therefor TORAY INDUSTRIES, INC. (JP) 2019-05-07 — — US disclosed
EP-3345893-A1 UREA DERIVATIVE AND USE THEREFOR Toray Industries, Inc. (JP) 2018-07-11 — — EP disclosed
WO-2017038873-A1 UREA DERIVATIVE AND USE THEREFOR 東レ株式会社 2017-03-09 — — 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-10280145-B2 Urea derivative and use therefor UTS2R, DDR1, WEE1 MAPK14 584/4885EPHX2 4826/4885KMT2A 3875/4885

“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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