SCHEMBL19377250

SCHEMBL19377250

COc1cc(S(=O)(=O)Cc2ccc3c(c2)CCNC3)ccc1NC(=O)NC(C)c1cccc(Cl)c1Cl

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MLNR O43193 9/20 0.39
▸ CYP2D6 P10635 2/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ LPAR1 Q92633 2/20 0.36
▸ ALK Q9UM73 2/20 0.36
▸ ROCK2 O75116 1/20 0.36
▸ RORC P51449 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ ITGB3 P05106 1/20 0.34
▸ ITGA2B P08514 1/20 0.34
▸ ITGA2 P17301 1/20 0.34

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
SCHEMBL19377500 1.00 MLNR (0.39) MLNRCYP2D6CYP3A4LPAR1ALK
SCHEMBL19377248 1.00 MLNR (0.39) MLNRCYP2D6CYP3A4LPAR1ALK
SCHEMBL19377345 0.94 LPAR1 (0.38) CYP3A4LPAR1RORCNPC1KMT2A
SCHEMBL19398902 0.94 MLNR (0.38) MLNRCYP2D6CYP3A4LPAR1ALK
SCHEMBL19398901 0.94 MLNR (0.38) MLNRCYP2D6CYP3A4LPAR1ALK
SCHEMBL19398905 0.94 MLNR (0.38) MLNRCYP2D6CYP3A4LPAR1ALK
SCHEMBL19398884 0.91 LPAR1 (0.39) LPAR1RORCNPC1KMT2AALDH1A1
SCHEMBL19377458 0.89 LPAR1 (0.35) MLNRLPAR1NPC1KMT2AALDH1A1
SCHEMBL19377082 0.89 CYP3A4 (0.40) MLNRCYP2D6CYP3A4
SCHEMBL19377280 0.88 ALK (0.36) CYP3A4LPAR1ALKKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3390355-B1 BENZENESULFONYL-ASYMMETRIC UREAS AND MEDICAL USES THEREOF HELSINN HEALTHCARE SA (CH) 2022-12-28 — — EP claimed
US-20170275301-A1 Benzenesulfonyl-Asymmetric Ureas and Medical Uses Thereof HELSINN HEALTHCARE SA (CH) 2017-09-28 — — US claimed
EP-3390355-B1 BENZENESULFONYL-ASYMMETRIC UREAS AND MEDICAL USES THEREOF HELSINN HEALTHCARE SA (CH) 2022-12-28 — — EP disclosed
EP-3390355-B1 BENZENESULFONYL-ASYMMETRIC UREAS AND MEDICAL USES THEREOF HELSINN HEALTHCARE SA (CH) 2022-12-28 — — EP disclosed
US-20170275301-A1 Benzenesulfonyl-Asymmetric Ureas and Medical Uses Thereof HELSINN HEALTHCARE SA (CH) 2017-09-28 — — US disclosed
US-20170275301-A1 Benzenesulfonyl-Asymmetric Ureas and Medical Uses Thereof HELSINN HEALTHCARE SA (CH) 2017-09-28 — — US disclosed
US-20170275301-A1 Benzenesulfonyl-Asymmetric Ureas and Medical Uses Thereof HELSINN HEALTHCARE SA (CH) 2017-09-28 — — US disclosed
WO-2017162390-A1 BENZENESULFONYL-ASYMMETRIC UREAS AND MEDICAL USES THEREOF HELSINN HEALTHCARE SA (CH) 2017-09-28 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170275301-A1 Benzenesulfonyl-Asymmetric Ureas and Medical Uses Thereof UTS2R, GHSR, GRPR MLNR 24/4885CYP2D6 3662/4885CYP3A4 4294/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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