SCHEMBL9410381

SCHEMBL9410381

CCc1nn(C)c(C(=O)NCc2ccc(OC(F)(F)C(F)OC(F)(F)F)c(F)c2)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ LMNA P02545 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ GALR3 O60755 1/20 0.41
▸ NR2F2 P24468 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ CYP2C9 P11712 4/20 0.38
▸ NPC1 O15118 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ ATM Q13315 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ KCNH2 Q12809 1/20 0.36
▸ CYP2C19 P33261 2/20 0.36
▸ PTGER4 P35408 1/20 0.36
▸ P2RX7 Q99572 3/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ HPGD P15428 1/20 0.35

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
SCHEMBL9319345 0.92 LMNA (0.42) SMN1; SMN2LMNARAB9AGALR3NR2F2
SCHEMBL9410414 0.90 LMNA (0.54) SMN1; SMN2LMNARAB9AGALR3NR2F2
SCHEMBL9410445 0.87 LMNA (0.47) SMN1; SMN2LMNARAB9AGALR3NR2F2
SCHEMBL9410427 0.86 LMNA (0.41) SMN1; SMN2LMNARAB9AGALR3NR2F2
SCHEMBL9410452 0.84 SMN1; SMN2 (0.39) SMN1; SMN2LMNARAB9AGALR3NR2F2
SCHEMBL9410403 0.84 RAB9A (0.39) SMN1; SMN2LMNARAB9AGALR3NR2F2
SCHEMBL9410480 0.83 GLS (0.38) SMN1; SMN2LMNARAB9AGALR3NR2F2
SCHEMBL9410468 0.82 LMNA (0.55) SMN1; SMN2LMNARAB9AGALR3NR2F2
SCHEMBL9410493 0.80 EPHX2 (0.40) SMN1; SMN2LMNARAB9AGALR3NR2F2
SCHEMBL9410459 0.79 LMNA (0.46) SMN1; SMN2LMNARAB9AGALR3NR2F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5366991-A Agriculture ENI CHEM SYNTHESIS S.P.A. (IT) 1994-11-22 — — US disclosed
EP-0590720-A1 Pyrazolecarboxamides exhibiting insecticidal and acaricidal activity MINISTERO DELL' UNIVERSITA' E DELLA RICERCA SCIENTIFICA E TECNOLOGICA (IT) 1994-04-06 — — EP disclosed
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