SCHEMBL18233497

SCHEMBL18233497

NCc1cccc(-c2ncc(C(F)(F)F)cn2)c1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 1/20 0.45
▸ MAOB P27338 3/20 0.44
▸ AGXT P21549 1/20 0.43
▸ CDK8 P49336 1/20 0.43
▸ HRH1 P35367 1/20 0.43
▸ HRH4 Q9H3N8 1/20 0.43
▸ LOXL2 Q9Y4K0 3/20 0.42
▸ TAAR1 Q96RJ0 1/20 0.42
▸ ADRB2 P07550 1/20 0.42
▸ LOX P28300 1/20 0.41
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ RXFP1 Q9HBX9 1/20 0.40
▸ MRGPRX4 Q96LA9 2/20 0.39
▸ IDO1 P14902 2/20 0.38

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
Hydrochloric Acid SCHEMBL18223887 0.98 MAOB (0.47) SYKMAOBAGXTCDK8HRH1
SCHEMBL16894197 0.82 MAOB (0.47) SYKMAOBAGXTCDK8HRH1
SCHEMBL1579740 0.79 ADRB2 (0.46) CDK8HRH1HRH4LOXL2TAAR1
SCHEMBL12547520 0.79 MET (0.46) CDK8LOXL2ADRB2LOX
SCHEMBL13492797 0.79 ADRB2 (0.46) SYKCDK8LOXL2TAAR1ADRB2
SCHEMBL3727416 0.78 MAOB (0.61) SYKMAOBAGXTHRH1HRH4
SCHEMBL29676764 0.78 ADRB2 (0.68) SYKCDK8LOXL2TAAR1ADRB2
SCHEMBL112429 0.78 ADRB2 (0.68) SYKCDK8LOXL2TAAR1ADRB2
SCHEMBL894079 0.77 AGXT (0.69) SYKMAOBAGXTTAAR1
SCHEMBL17048549 0.77 MAOB (0.51) SYKMAOBAGXTCDK8HRH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10626112-B2 Heterocyclic sulfonamide derivative and medicine comprising same EA PHARMA CO., LTD. (JP) 2020-04-21 — — US disclosed
US-20160332999-A1 HETEROCYCLIC SULFONAMIDE DERIVATIVE AND MEDICINE COMPRISING SAME EA PHARMA CO., LTD. (JP) 2016-11-17 — — US disclosed
US-20160332999-A1 HETEROCYCLIC SULFONAMIDE DERIVATIVE AND MEDICINE COMPRISING SAME EA PHARMA CO., LTD. (JP) 2016-11-17 — — US 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 (2 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-20160332999-A1 HETEROCYCLIC SULFONAMIDE DERIVATIVE AND MEDICINE COMPRISING SAME TRPA1, TRPV1, TRPV2 SYK 2113/4885MAOB 2570/4885AGXT 1521/4885
US-10626112-B2 Heterocyclic sulfonamide derivative and medicine comprising same TRPA1, TRPV1, TRPV2 SYK 2113/4885MAOB 2570/4885AGXT 1521/4885

“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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