SCHEMBL10371900

SCHEMBL10371900

CCC1CN(c2ncc(C(F)(F)F)cn2)CCN1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 3/20 0.46
CHRM1 P11229 3/20 0.46
CHRM3 P20309 2/20 0.46
SLC6A9 P48067 14/20 0.46
CHRM4 P08173 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
SCHEMBL27233831 1.00 CHRM2 (0.46) CHRM2CHRM1CHRM3SLC6A9CHRM4
SCHEMBL27233824 1.00 CHRM2 (0.46) CHRM2CHRM1CHRM3SLC6A9CHRM4
SCHEMBL27233776 0.89 TRPV4 (0.47) CHRM2CHRM1CHRM3SLC6A9
SCHEMBL27233820 0.89 TRPV4 (0.47) CHRM2CHRM1CHRM3SLC6A9
SCHEMBL27233780 0.89 TRPV4 (0.47) CHRM2CHRM1CHRM3SLC6A9
SCHEMBL27233843 0.87 CHRM2 (0.44) CHRM2CHRM1CHRM3SLC6A9CHRM4
SCHEMBL27233841 0.87 CHRM2 (0.44) CHRM2CHRM1CHRM3SLC6A9CHRM4
SCHEMBL10373050 0.85 SLC6A7 (0.46) CHRM2CHRM1SLC6A9
SCHEMBL28966574 0.85 GPR119 (0.47) CHRM2CHRM1CHRM3SLC6A9CHRM4
SCHEMBL28966511 0.85 GPR119 (0.47) CHRM2CHRM1CHRM3SLC6A9CHRM4

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-4378938-A1 NOVEL PARP7 INHIBITOR AND USE THEREOF Shanghai Qilu Pharmaceutical Research and Development Centre Ltd. (CN) 2024-06-05 EP disclosed
CN-117642393-A Novel PARP7 inhibitor and application thereof 上海齐鲁制药研究中心有限公司 2024-03-01 CN disclosed
CN-115745971-A PARP7 inhibitor and application thereof 重庆华森制药股份有限公司 2023-03-07 CN disclosed
EP-0129128-B1 2-PYRIMIDINYL-1-PIPERAZINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THEM Troponwerke GmbH & Co. KG (DE) 1990-11-22 EP disclosed