SCHEMBL19377221

SCHEMBL19377221

CN1Cc2ccc(CS(=O)(=O)c3ccc(NC(=O)NCC4CC4)cc3)cc2C1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ ALDH1A1 P00352 2/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ NAMPT P43490 10/20 0.43
▸ DRD2 P14416 1/20 0.41
▸ HTR2A P28223 1/20 0.41
▸ HTR2C P28335 1/20 0.41
▸ DRD3 P35462 1/20 0.41
▸ HTR6 P50406 1/20 0.41
▸ CCR3 P51677 1/20 0.41
▸ RORC P51449 1/20 0.41
▸ EPHX1 P07099 1/20 0.41
▸ EPHX2 P34913 1/20 0.41
▸ POLB P06746 1/20 0.40

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
SCHEMBL19377398 0.85 DRD2 (0.42) NAMPTDRD2HTR2AHTR2CDRD3
SCHEMBL19377287 0.85 RORC (0.45) ALDH1A1NAMPTDRD2HTR2AHTR2C
SCHEMBL19377304 0.84 NAMPT (0.60) NAMPTRORC
SCHEMBL19377046 0.82 EPHX2 (0.46) L3MBTL1NAMPTDRD2HTR2AHTR2C
SCHEMBL19406974 0.82 DRD2 (0.47) ALDH1A1L3MBTL1NAMPTDRD2HTR2A
SCHEMBL19377329 0.81 DRD2 (0.42) NAMPTDRD2HTR2AHTR2CDRD3
SCHEMBL24800255 0.80 NAMPT (0.48) NAMPTRORCEPHX2
SCHEMBL30162472 0.78 NAMPT (0.50) ALDH1A1NAMPTRORC
SCHEMBL19377151 0.78 NAMPT (0.50) ALDH1A1NAMPTRORC
SCHEMBL19377317 0.78 HSD17B10 (0.48) ALDH1A1NAMPTEPHX2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170275301-A1 Benzenesulfonyl-Asymmetric Ureas and Medical Uses Thereof HELSINN HEALTHCARE SA (CH) 2017-09-28 — — US claimed
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 NPC1 3205/4885RAB9A 4307/4885ALDH1A1 3527/4885

“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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