SCHEMBL9050784

SCHEMBL9050784

Cc1ccc(S(=O)(=O)N([C@H]2CC[C@H](N)C[C@@H]2c2ccc(Cl)nc2)S(=O)(=O)c2ccc(C)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 2/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ CHRNB2 P17787 7/20 0.37
▸ CHRNA4 P43681 6/20 0.37
▸ MAPT P10636 1/20 0.36
▸ CHRNA7 P36544 4/20 0.36
▸ CHRNA3 P32297 3/20 0.36
▸ CHRNB4 P30926 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ CHRNA1 P02708 1/20 0.35
▸ CHRNG P07510 1/20 0.35
▸ CHRNB1 P11230 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ CHRND Q07001 1/20 0.35
▸ CHRNA2 Q15822 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ MAOA P21397 1/20 0.35
▸ MAOB P27338 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
SCHEMBL8977393 1.00 KDM1A (0.38) KDM1ASMN1; SMN2CHRNB2CHRNA4MAPT
SCHEMBL8977326 0.82 MAPT (0.38) SMN1; SMN2CHRNB2CHRNA4MAPTCHRNA7
SCHEMBL9049929 0.82 MAPT (0.38) SMN1; SMN2CHRNB2CHRNA4MAPTCHRNA7
SCHEMBL9053877 0.70 CHRNB2 (0.39) CHRNB2CHRNA4CHRNA7CHRNA3CHRNB4
SCHEMBL14062319 0.65 ACHE (0.49) SMN1; SMN2MAPTALDH1A1MEN1KMT2A
SCHEMBL28010137 0.65 ALDH1A1 (0.43) SMN1; SMN2MAPTALDH1A1MEN1KMT2A
SCHEMBL8977392 0.65 CHRNA7 (0.35) KDM1AMAPTCHRNA7MEN1KMT2A
SCHEMBL5938566 0.64 CHRNB2 (0.39) CHRNB2CHRNA4CHRNA7CHRNA3CHRNB4
SCHEMBL5938292 0.63 CHRNB2 (0.40) CHRNB2CHRNA4CHRNA7CHRNA3CHRNB4
SCHEMBL4825516 0.63 GPR119 (0.43) CHRNB2CHRNA4CHRNA3CHRNB4ALDH1A1

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
EP-0736534-A1 Process for preparing epibatidine EGIS GYOGYSZERGYAR RT. (HU) 1996-10-09 — — EP disclosed
EP-0657456-A1 Process for preparing epibatidine EGIS GYOGYSZERGYAR RT. (HU) 1995-06-14 — — EP disclosed
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