SCHEMBL3150833

SCHEMBL3150833

NCCOc1ccc2c(c1)CCC2

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.56
NPC1 O15118 3/20 0.55
RAB9A P51151 3/20 0.55
NFKB1 P19838 1/20 0.55
NFKB2 Q00653 1/20 0.55
RELA Q04206 1/20 0.55
TSHR P16473 2/20 0.52
KDM4E B2RXH2 2/20 0.52
POLB P06746 1/20 0.52
ALOX15 P16050 4/20 0.51
HSD17B10 Q99714 1/20 0.51
ALDH1A1 P00352 3/20 0.50
HPGD P15428 2/20 0.50
PPARG P37231 1/20 0.50
PPARD Q03181 1/20 0.50
MAPT P10636 2/20 0.48
LMNA P02545 2/20 0.48
TP53 P04637 1/20 0.48
RXRA P19793 2/20 0.48
RXRB P28702 2/20 0.48

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
SCHEMBL10439500 0.87 ALOX15 (0.54) SMN1; SMN2NPC1RAB9ANFKB1NFKB2
SCHEMBL9720056 0.84 PPARG (0.64) SMN1; SMN2NPC1RAB9ANFKB1NFKB2
SCHEMBL15625501 0.81 KDM4E (0.60) SMN1; SMN2NPC1RAB9ANFKB1NFKB2
SCHEMBL29825051 0.81 SMN1; SMN2 (0.56) SMN1; SMN2NPC1RAB9ANFKB1NFKB2
SCHEMBL7214609 0.81 SMN1; SMN2 (0.56) SMN1; SMN2NPC1RAB9ANFKB1NFKB2
SCHEMBL23222346 0.81 SMN1; SMN2 (0.56) SMN1; SMN2NPC1RAB9ANFKB1NFKB2
SCHEMBL10602491 0.81 TSHR (0.59) SMN1; SMN2NPC1RAB9ANFKB1NFKB2
SCHEMBL9796002 0.80 SMN1; SMN2 (0.57) SMN1; SMN2NPC1RAB9ANFKB1NFKB2
SCHEMBL1799468 0.79 PDK2 (0.47) ALDH1A1LMNA
SCHEMBL9720055 0.79 ALOX15 (0.59) SMN1; SMN2NPC1RAB9ANFKB1NFKB2

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
EP-1389183-B1 SULFONAMIDE DERIVATIVES NOVARTIS AG (CH) 2010-03-03 EP disclosed
US-7109203-B2 Sulfonamide derivatives NOVARTIS AG (CH) 2006-09-19 US disclosed
US-20040127533-A1 Sulfonamide derivatives NOVARTIS AG (CH) 2004-07-01 US disclosed
EP-1389183-A1 SULFONAMIDE DERIVATIVES Novartis AG (CH) 2004-02-18 EP disclosed
WO-2002092556-A1 SULFONAMIDE DERIVATIVES NOVARTIS AG (CH) 2002-11-21 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-20040127533-A1 Sulfonamide derivatives BDKRB1, BDKRB2, BRS3 SMN1; SMN2 2071/4885NPC1 1847/4885RAB9A 2110/4885

“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.