SCHEMBL11209757

SCHEMBL11209757

O=C1CCC(=O)N1c1cccc(Cl)c1S(=O)(=O)O

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.38
▸ RAF1 P04049 1/20 0.38
▸ MAPK3 P27361 1/20 0.38
▸ MAP3K8 P41279 1/20 0.38
▸ MAP2K1 Q02750 1/20 0.38
▸ POLB P06746 2/20 0.38
▸ NOTUM Q6P988 2/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ CNR1 P21554 1/20 0.36
▸ MGLL Q99685 1/20 0.36
▸ GRM4 Q14833 1/20 0.36
▸ MAPK14 Q16539 1/20 0.35
▸ AADAT Q8N5Z0 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
SCHEMBL10983121 0.82 MGLL (0.58) MGLL
SCHEMBL2470770 0.75 RAD51 (0.48) KMT2APOLBNOTUMMGLL
SCHEMBL3786268 0.75 MGLL (0.61) KMT2ARAF1MAPK3MAP3K8MAP2K1
SCHEMBL440935 0.74 ALDH1A1 (0.44) KMT2APOLBSMN1; SMN2CNR1
Hydrochloric Acid SCHEMBL27552065 0.72 ALDH1A1 (0.42) KMT2APOLBSMN1; SMN2CNR1
SCHEMBL9192753 0.69 RAF1 (0.44) KMT2ARAF1MAPK3MAP3K8MAP2K1
SCHEMBL149755 0.69 TTR (0.44) KMT2APOLBCNR1MAPK14
SCHEMBL2844949 0.69 NSD2 (0.39) KMT2APOLBSMN1; SMN2CNR1
SCHEMBL6341570 0.68 TLR9 (0.52) KMT2ARAF1MAPK3MAP3K8MAP2K1
SCHEMBL5728040 0.67 TSHR (0.48) KMT2APOLBCNR1

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
US-4287106-A ACRYLATE MONOMER, DIENE POLYMER CIBA-GEIGY CORPORATION (US) 1981-09-01 — — US claimed
EP-0008110-B1 ADHESIVES OR ADHESIVE CONSTITUENTS AND THEIR USE FOR BONDING TWO SURFACES CIBA-GEIGY AG (CH) 1983-04-06 — — EP disclosed
US-4287106-A ACRYLATE MONOMER, DIENE POLYMER CIBA-GEIGY CORPORATION (US) 1981-09-01 — — US disclosed
EP-0008110-A2 Adhesives or adhesive constituents and their use for bonding two surfaces CIBA-GEIGY AG (CH) 1980-02-20 — — EP disclosed
Send feedback