SCHEMBL4295231

SCHEMBL4295231

COC(=O)CCCC1CCCCN1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.40
TSHR P16473 2/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
HPGD P15428 1/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
FKBP1A P62942 2/20 0.37
GLA P06280 1/20 0.37
MAPT P10636 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL25424099 0.95 TSHR (0.41) EPHX2TSHRNPC1RAB9AHPGD
SCHEMBL25424091 0.95 TSHR (0.41) EPHX2TSHRNPC1RAB9AHPGD
SCHEMBL29039246 0.91 TSHR (0.40) EPHX2TSHRKMT2AGLASMN1; SMN2
SCHEMBL19947263 0.86 POLB (0.40) EPHX2TSHRKMT2ASMN1; SMN2
SCHEMBL19947264 0.86 POLB (0.40) EPHX2TSHRKMT2ASMN1; SMN2
SCHEMBL13731844 0.86 FKBP1A (0.40) NPC1RAB9AHPGDKMT2AMEN1
SCHEMBL702497 0.82 ATM (0.43) HPGDFKBP1ASMN1; SMN2
SCHEMBL13673248 0.82 CYP1A2 (0.47) EPHX2TSHRGLASMN1; SMN2
SCHEMBL1779547 0.81 L3MBTL1 (0.38) NPC1RAB9AHPGDKMT2AFKBP1A
SCHEMBL3035722 0.81 L3MBTL1 (0.38) NPC1RAB9AHPGDKMT2AFKBP1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8318769-B2 Substituted sulfonamide compounds GRUENETHAL GMBH (DE) 2012-11-27 US disclosed
US-20090264400-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-10-22 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 (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-20090264400-A1 Substituted Sulfonamide Compounds BDKRB1, BDKRB2, TRPV1 EPHX2 1631/4885TSHR 1575/4885NPC1 2705/4885

“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.