SCHEMBL20357312

SCHEMBL20357312

COc1c(CO)cc(C(F)(F)F)cc1NC(=O)NC1CCC(OCc2ccncc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 2/20 0.43
▸ FPR1 P21462 1/20 0.38
▸ FPR2 P25090 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ EPHX2 P34913 8/20 0.38
▸ MAPT P10636 3/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ KCNH2 Q12809 1/20 0.38
▸ MCHR1 Q99705 1/20 0.38
▸ ALDH1A1 P00352 3/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ LMNA P02545 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ TACR1 P25103 1/20 0.37
▸ FAAH O00519 1/20 0.36
▸ TRPV1 Q8NER1 1/20 0.36
▸ EPHX1 P07099 1/20 0.35

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
SCHEMBL18615611 1.00 MAPK14 (0.43) MAPK14FPR1FPR2GAAEPHX2
SCHEMBL20357351 0.84 KDR (0.46) GAAEPHX2MAPTKMT2AALDH1A1
SCHEMBL18615495 0.84 KDR (0.46) GAAEPHX2MAPTKMT2AALDH1A1
SCHEMBL18615684 0.82 CRHR1 (0.45) MAPK14GAAEPHX2
SCHEMBL20357290 0.82 CRHR1 (0.45) MAPK14GAAEPHX2
SCHEMBL18615489 0.82 MAPK14 (0.44) MAPK14FPR1FPR2EPHX2MAPT
SCHEMBL20357294 0.82 MAPK14 (0.44) MAPK14FPR1FPR2EPHX2MAPT
SCHEMBL18615456 0.81 CXCR3 (0.48) GAAEPHX2KMT2A
SCHEMBL20357421 0.81 CXCR3 (0.48) GAAEPHX2KMT2A
SCHEMBL18615487 0.81 MAPK14 (0.49) MAPK14GAAEPHX2KMT2AKDM4E

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
US-20180237398-A1 UREA DERIVATIVE AND USE THEREFOR TORAY INDUSTRIES, INC. (JP) 2018-08-23 — — US disclosed
EP-3345893-A1 UREA DERIVATIVE AND USE THEREFOR Toray Industries, Inc. (JP) 2018-07-11 — — EP 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 (2 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 584/4885FPR1 515/4885FPR2 2086/4885
US-20180237398-A1 UREA DERIVATIVE AND USE THEREFOR UTS2R, DDR1, WEE1 MAPK14 584/4885FPR1 515/4885FPR2 2086/4885

“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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