SCHEMBL21239464

SCHEMBL21239464

CC[C@](C)(NC(=O)Nc1ccc(Cl)cc1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ FPR2 P25090 2/20 0.57
▸ SMN1; SMN2 Q16637 3/20 0.54
▸ TSHR P16473 1/20 0.54
▸ ALDH1A1 P00352 1/20 0.51
▸ MEN1 O00255 4/20 0.50
▸ KMT2A Q03164 4/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ CNR1 P21554 4/20 0.48
▸ MAPT P10636 3/20 0.47
▸ HTT P42858 2/20 0.47
▸ NPC1 O15118 2/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ NLRP1 Q9C000 1/20 0.47
▸ MAPK14 Q16539 1/20 0.46
▸ CASR P41180 1/20 0.46
▸ GAA P10253 1/20 0.45

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
SCHEMBL21239463 1.00 FPR2 (0.57) FPR2SMN1; SMN2TSHRALDH1A1MEN1
SCHEMBL21239484 1.00 FPR2 (0.57) FPR2SMN1; SMN2TSHRALDH1A1MEN1
SCHEMBL21239461 0.85 FPR2 (0.77) FPR2SMN1; SMN2MEN1KMT2ACNR1
SCHEMBL21239460 0.85 FPR2 (0.77) FPR2SMN1; SMN2MEN1KMT2ACNR1
SCHEMBL21239550 0.85 FPR2 (0.57) FPR2MEN1KMT2ACNR1MAPT
SCHEMBL21239537 0.85 FPR2 (0.77) FPR2SMN1; SMN2MEN1KMT2ACNR1
SCHEMBL21239527 0.85 FPR2 (0.57) FPR2MEN1KMT2ACNR1MAPT
SCHEMBL21239525 0.85 FPR2 (0.57) FPR2MEN1KMT2ACNR1MAPT
SCHEMBL21239487 0.84 POLB (0.64) FPR2ALDH1A1MEN1KMT2AMAPT
SCHEMBL29874164 0.84 POLB (0.64) FPR2ALDH1A1MEN1KMT2AMAPT

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109843283-B Urea derivatives 第一三共株式会社 2022-08-30 — — CN disclosed
US-20220144765-A1 UREA DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2022-05-12 — — US disclosed
US-20220144765-A1 UREA DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2022-05-12 — — US disclosed
US-20210206716-A1 UREA DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2021-07-08 — — US disclosed
US-20210206716-A1 UREA DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2021-07-08 — — US disclosed
US-10968169-B2 Urea derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2021-04-06 — — US disclosed
US-10968169-B2 Urea derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2021-04-06 — — US disclosed
EP-3524240-A1 UREA DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2019-08-14 — — EP disclosed
CN-109843283-A Urea derivative 第一三共株式会社 2019-06-04 — — CN 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 (3 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-20210206716-A1 UREA DERIVATIVE IDO1, IDO2, TPH1 FPR2 1882/4885SMN1; SMN2 4752/4885TSHR 1451/4885
US-10968169-B2 Urea derivative IDO1, IDO2, UTS2R FPR2 2003/4885SMN1; SMN2 4771/4885TSHR 1396/4885
US-20220144765-A1 UREA DERIVATIVE IDO1, IDO2, TPH1 FPR2 1882/4885SMN1; SMN2 4752/4885TSHR 1451/4885

“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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