SCHEMBL3040976

SCHEMBL3040976

O=S(=O)(NCC1CC1)c1ccc(Nc2ccc(F)cc2F)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 7/20 1.00
CNR1 P21554 4/20 1.00
SOS1 Q07889 1/20 0.58
GBA1 P04062 1/20 0.50
HTR1A P08908 1/20 0.46
DRD2 P14416 1/20 0.46
HTR7 P34969 1/20 0.46
HTR6 P50406 1/20 0.46
NPC1 O15118 1/20 0.46
PARG Q86W56 1/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
ALDH1A1 P00352 1/20 0.45
ALDH3A1 P30838 1/20 0.45
IDH2 P48735 2/20 0.44

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
SCHEMBL13456174 0.82 CNR2 (0.74) CNR2CNR1MEN1KMT2A
SCHEMBL3038875 0.81 CNR2 (1.00) CNR2CNR1
SCHEMBL6799277 0.81 GBA1 (0.69) CNR2CNR1GBA1HTR1ADRD2
SCHEMBL14606690 0.74 GBA1 (0.59) CNR2CNR1GBA1HTR1ADRD2
SCHEMBL1594065 0.74 GBA1 (0.59) CNR2CNR1GBA1HTR1ADRD2
SCHEMBL3043510 0.74 CNR1 (0.70) CNR2CNR1SOS1MEN1KMT2A
SCHEMBL18025447 0.74 SOS1 (1.00) CNR2CNR1SOS1
SCHEMBL3035205 0.73 CNR2 (1.00) CNR2CNR1GBA1NPC1MEN1
SCHEMBL3025163 0.73 CNR2 (0.57) CNR2CNR1GBA1NPC1PARG
SCHEMBL7263560 0.72 GBA1 (0.65) CNR2CNR1GBA1PARGMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100056528-A1 SULFONAMIDE DERIVATIVES WITH THERAPEUTIC INDICATIONS PHARMOS CORPORATION 2010-03-04 US claimed
EP-2139852-A1 SULFONAMIDE DERIVATIVES WITH THERAPEUTIC INDICATIONS Pharmos Corporation (US) 2010-01-06 EP claimed
WO-2008075353-A1 SULFONAMIDE DERIVATIVES WITH THERAPEUTIC INDICATIONS PHARMOS CORPORATION (US) 2008-06-26 WO claimed
US-9422235-B2 Sulfonamide derivatives with therapeutic indications PHARMOS CORPORATION (US) 2016-08-23 US disclosed
US-9422235-B2 Sulfonamide derivatives with therapeutic indications PHARMOS CORPORATION (US) 2016-08-23 US disclosed
US-20100056528-A1 SULFONAMIDE DERIVATIVES WITH THERAPEUTIC INDICATIONS PHARMOS CORPORATION 2010-03-04 US disclosed
US-20100056528-A1 SULFONAMIDE DERIVATIVES WITH THERAPEUTIC INDICATIONS PHARMOS CORPORATION 2010-03-04 US disclosed
EP-2139852-A1 SULFONAMIDE DERIVATIVES WITH THERAPEUTIC INDICATIONS Pharmos Corporation (US) 2010-01-06 EP disclosed
WO-2008075353-A1 SULFONAMIDE DERIVATIVES WITH THERAPEUTIC INDICATIONS PHARMOS CORPORATION (US) 2008-06-26 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-20100056528-A1 SULFONAMIDE DERIVATIVES WITH THERAPEUTIC INDICATIONS SULT2A1, STS, SULT1A1 CNR2 41/4885CNR1 207/4885SOS1 704/4885

“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.