SCHEMBL9678598

SCHEMBL9678598

CC1=NN(C(=O)NS(=O)(=O)c2ccccc2Cl)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RY12 Q9H244 3/20 0.48
▸ HTR6 P50406 3/20 0.44
▸ POLB P06746 1/20 0.42
▸ FLT1 P17948 1/20 0.42
▸ FLT4 P35916 1/20 0.42
▸ KDR P35968 1/20 0.42
▸ FAAH O00519 2/20 0.41
▸ HRH1 P35367 1/20 0.41
▸ CCR3 P51677 1/20 0.41
▸ CNR1 P21554 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ HDAC3 O15379 1/20 0.39
▸ HDAC4 P56524 1/20 0.39
▸ HDAC1 Q13547 1/20 0.39
▸ HDAC7 Q8WUI4 1/20 0.39
▸ HDAC2 Q92769 1/20 0.39
▸ HDAC10 Q969S8 1/20 0.39
▸ HDAC11 Q96DB2 1/20 0.39

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
SCHEMBL9678675 0.87 P2RY12 (0.44) P2RY12HTR6HRH1CCR3GAA
SCHEMBL9678253 0.86 HTR6 (0.47) P2RY12HTR6POLBCNR1GAA
SCHEMBL9677118 0.86 HTR6 (0.40) P2RY12HTR6HRH1CCR3
SCHEMBL9676824 0.85 HTR6 (0.40) P2RY12HTR6POLB
SCHEMBL9678476 0.85 KAT6A (0.40) HTR6CNR1TSHR
SCHEMBL9679216 0.84 HTR6 (0.46) P2RY12HTR6POLBFLT1FLT4
SCHEMBL9676959 0.83 HTR6 (0.41) P2RY12HTR6GAA
SCHEMBL9678605 0.82 KMT2A (0.46) POLB
SCHEMBL9676435 0.82 CA1 (0.46) POLBGAAHSD17B10CA1CA2
SCHEMBL9678257 0.82 HTR6 (0.50) P2RY12HTR6GAACA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0269141-B1 1-CARBAMOYL-2-PYRAZOLINE DERIVATIVES HAVING HERBICIDAL ACTIVITY DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1992-09-16 — — EP disclosed
US-4927452-A 1-carbonyl-2-pyrazoline derivatives having herbicidal activity DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1990-05-22 — — US disclosed
EP-0269141-A2 1-Carbamoyl-2-pyrazoline derivatives having herbicidal activity DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1988-06-01 — — EP disclosed
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