SCHEMBL17327675

SCHEMBL17327675

COc1c(Cl)cc(-c2nc(N)sc2CN2CCC[C@H]2C)cc1Cl

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ HRH3 Q9Y5N1 6/20 0.36
▸ MAPT P10636 1/20 0.35
▸ CRHBP P24387 1/20 0.35
▸ CRHR2 Q13324 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ BMPR1B O00238 3/20 0.35
▸ BMPR1A P36894 3/20 0.35
▸ TGFBR1 P36897 3/20 0.35
▸ ACVRL1 P37023 3/20 0.35
▸ ACVR1 Q04771 3/20 0.35
▸ MAP4K4 O95819 1/20 0.34
▸ CRHR1 P34998 1/20 0.34
▸ HTT P42858 1/20 0.34

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
SCHEMBL18724248 0.93 HRH3 (0.40) ALDH1A1MEN1KMT2AHRH3MAPT
SCHEMBL18724244 0.93 HRH3 (0.40) ALDH1A1MEN1KMT2AHRH3MAPT
SCHEMBL19107799 0.88 ALDH1A1 (0.40) ALDH1A1MEN1KMT2AHRH3SMN1; SMN2
SCHEMBL21007325 0.85 CRHR1 (0.39) ALDH1A1KMT2AHRH3MAPTCRHBP
SCHEMBL19107789 0.83 MAP4K4 (0.37) ALDH1A1MEN1KMT2AHRH3BMPR1B
SCHEMBL21301061 0.82 MAPT (0.38) ALDH1A1KMT2AHRH3MAPTCRHBP
SCHEMBL19156485 0.82 HRH3 (0.41) ALDH1A1MEN1KMT2AHRH3MAPT
SCHEMBL18723922 0.82 HRH3 (0.39) MEN1KMT2AHRH3MAPTCRHBP
SCHEMBL18723920 0.82 HRH3 (0.39) MEN1KMT2AHRH3MAPTCRHBP
SCHEMBL18724143 0.81 KMT2A (0.41) ALDH1A1MEN1KMT2AHRH3MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE49111-E1 2-acylaminothiazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2022-06-21 — — US disclosed
EP-3153511-B1 2-ACYLAMINOTHIAZOLE DERIVATIVE FOR USE IN THE PREVENTION OR TREATMENT OF BLADDER/URINARY TRACT DISEASES ASTELLAS PHARMA INC (JP) 2019-05-15 — — EP disclosed
US-9951060-B2 2-acylaminothiazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2018-04-24 — — US disclosed
US-20170197955-A1 2-ACYLAMINOTHIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2017-07-13 — — US disclosed
EP-3153511-A1 2-ACYLAMINOTHIAZOLE DERIVATIVE OR SALT THEREOF Astellas Pharma Inc. (JP) 2017-04-12 — — EP disclosed
WO-2015186821-A1 2-ACYLAMINOTHIAZOLE DERIVATIVE OR SALT THEREOF アステラス製薬株式会社 2015-12-10 — — 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-20170197955-A1 2-ACYLAMINOTHIAZOLE DERIVATIVE OR SALT THEREOF CHRM3, CHRM2, TRPM2 ALDH1A1 1551/4885MEN1 4023/4885KMT2A 645/4885

“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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