SCHEMBL21314948

SCHEMBL21314948

Cn1nc(C(=O)O)cc1-c1cccc(C(F)(F)F)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMO O15229 2/20 0.53
▸ TSHR P16473 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ XDH P47989 1/20 0.47
▸ PIN1 Q13526 1/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ ATM Q13315 1/20 0.47
▸ LDHA P00338 1/20 0.47
▸ CHRNB2 P17787 3/20 0.46
▸ CHRNB4 P30926 3/20 0.46
▸ CHRNA3 P32297 3/20 0.46
▸ CHRNA4 P43681 3/20 0.46
▸ KMT2A Q03164 1/20 0.45
▸ DYRK1A Q13627 4/20 0.45
▸ DYRK2 Q92630 4/20 0.45
▸ CCNA2 P20248 3/20 0.44
▸ CDK2 P24941 3/20 0.44
▸ CDK5 Q00535 3/20 0.44
▸ CDK5R1 Q15078 3/20 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
SCHEMBL30504023 1.00 KMO (0.53) KMOTSHRALDH1A1SMN1; SMN2XDH
SCHEMBL27656186 0.85 CHRNB2 (0.60) ALDH1A1SMN1; SMN2ATMCHRNB2CHRNB4
SCHEMBL10958938 0.83 FAAH (0.54) ALDH1A1KMT2AGRM5KDM4E
SCHEMBL30504042 0.83 FAAH (0.54) ALDH1A1KMT2AGRM5KDM4E
SCHEMBL570061 0.81 RPA1 (0.63) ALDH1A1SMN1; SMN2KMT2AGRM5KDM4E
SCHEMBL1110618 0.80 PPP1CA (0.60) ALDH1A1SMN1; SMN2KMT2A
SCHEMBL14758758 0.79 PPP1CA (0.56) KMOALDH1A1SMN1; SMN2KMT2AGRM5
SCHEMBL2203114 0.79 RPA1 (0.51) ALDH1A1NPC1KMT2AGRM5
SCHEMBL1764955 0.79 KMT2A (0.73) SMN1; SMN2ATMKMT2A
SCHEMBL1765345 0.78 RPA1 (0.67) SMN1; SMN2ATMKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113994970-B Substituted sulfonamides for combating animal pests 拜耳公司 2023-05-12 — — CN disclosed
CN-113994970-A Substituted sulfonamides for combating animal pests 拜耳公司 2022-02-01 — — CN disclosed
EP-3534709-B1 SUBSTITUTED SULFONYLAMIDE FOR COMBATING ANIMAL PESTS BAYER AG (DE) 2021-06-16 — — EP disclosed
US-10820591-B2 Substituted sulfonyl amides for controlling animal pests BAYER AKTIENGESELLSCHAFT (DE) 2020-11-03 — — US disclosed
US-10820591-B2 Substituted sulfonyl amides for controlling animal pests BAYER AKTIENGESELLSCHAFT (DE) 2020-11-03 — — US disclosed
EP-3534709-A1 SUBSTITUTED SULFONYL AMIDES FOR CONTROLLING ANIMAL PESTS Bayer Aktiengesellschaft (DE) 2019-09-11 — — EP disclosed
US-20190269134-A1 SUBSTITUTED SULFONYL AMIDES FOR CONTROLLING ANIMAL PESTS BAYER AKTIENGESELLSCHAFT (DE) 2019-09-05 — — US disclosed
US-20190269134-A1 SUBSTITUTED SULFONYL AMIDES FOR CONTROLLING ANIMAL PESTS BAYER AKTIENGESELLSCHAFT (DE) 2019-09-05 — — US disclosed
CN-110191639-A Substituted sulfonamides for combating animal pests 拜耳公司 2019-08-30 — — CN disclosed
US-20160172605-A1 Light-Emitting Element SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2016-06-16 — — 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 (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-20190269134-A1 SUBSTITUTED SULFONYL AMIDES FOR CONTROLLING ANIMAL PESTS MLYCD, STOM, DDT KMO 2588/4885TSHR 1898/4885ALDH1A1 2367/4885
US-10820591-B2 Substituted sulfonyl amides for controlling animal pests MLYCD, STOM, DDT KMO 2588/4885TSHR 1898/4885ALDH1A1 2367/4885

“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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