SCHEMBL24762049

SCHEMBL24762049

O=C(N1CCN(C2(c3ccc(Br)cc3)CC2)CC1)C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CXCR3 P49682 1/20 0.40
▸ S1PR2 O95136 1/20 0.37
▸ HSD11B1 P28845 2/20 0.36
▸ ESR1 P03372 3/20 0.34
▸ ESR2 Q92731 3/20 0.34
▸ HPGD P15428 1/20 0.34
▸ GPR183 P32249 2/20 0.34
▸ CA12 O43570 1/20 0.34
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34
▸ CA7 P43166 1/20 0.34
▸ CA9 Q16790 1/20 0.34
▸ CA14 Q9ULX7 1/20 0.34
▸ RORC P51449 2/20 0.33
▸ EPHX1 P07099 1/20 0.33
▸ EPHX2 P34913 1/20 0.33
▸ ALK Q9UM73 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ AKR1C3 P42330 1/20 0.33
▸ AKT1 P31749 1/20 0.32

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
SCHEMBL24762716 0.81 RORC (0.34) CA12CA1CA2CA7CA9
SCHEMBL27238569 0.80 GRIN2D (0.41) CXCR3HSD11B1MAPK1
SCHEMBL22532728 0.77 RORC (0.48) ESR1RORC
SCHEMBL24762050 0.76 LMNA (0.41) HPGD
SCHEMBL18321520 0.74 MAPT (0.41) CXCR3S1PR2HPGDGPR183CA12
SCHEMBL20639966 0.74 AKR1C3 (0.58) HPGDCA12CA1CA2CA9
SCHEMBL24763409 0.74 AKR1C3 (0.36) HSD11B1ESR1ESR2AKR1C3
SCHEMBL24763407 0.74 AKR1C3 (0.36) ESR1ESR2MAPK1AKR1C3
SCHEMBL1141340 0.72 GRIN1 (0.55) HSD11B1HPGD
SCHEMBL25053839 0.72 GRIN1 (0.44) HSD11B1CA12CA1CA2CA7

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-20240190821-A1 SULFONAMIDE SUBSTITUTED N-(1H-INDOL-7-YL)BENZENESULFONAMIDES AND USES THEREOF TRIANA BIOMEDICINES INC (US) 2024-06-13 — — US disclosed
WO-2022169755-A1 SULFONAMIDE SUBSTITUTED N-(1H-INDOL-7-YL) BENZENESULFONAMIDES AND USES THEREOF TRIANA BIOMEDICINES, INC. (US) 2022-08-11 — — WO disclosed
WO-2022169755-A1 SULFONAMIDE SUBSTITUTED N-(1H-INDOL-7-YL) BENZENESULFONAMIDES AND USES THEREOF TRIANA BIOMEDICINES, INC. (US) 2022-08-11 — — 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-20240190821-A1 SULFONAMIDE SUBSTITUTED N-(1H-INDOL-7-YL)BENZENESULFONAMIDES AND USES THEREOF PACSIN2, TPX2, PRSS12 CXCR3 4117/4885S1PR2 4330/4885HSD11B1 3450/4885

“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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