SCHEMBL4956015

SCHEMBL4956015

O=S(=O)(C[CH]C#Cc1ccc2c(c1)OCO2)N1CCN(c2ccc(F)cc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.47
MAPT P10636 4/20 0.46
ALDH1A1 P00352 4/20 0.46
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
ADAMTS4 O75173 4/20 0.41
CYP3A4 P08684 2/20 0.40
MEN1 O00255 1/20 0.40
TSHR P16473 1/20 0.40
KMT2A Q03164 1/20 0.40
MMP13 P45452 3/20 0.39
MMP14 P50281 3/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL2155419 0.83 LMNA (0.47) KDM4EMAPTALDH1A1NPC1RAB9A
SCHEMBL2154986 0.83 LMNA (0.47) KDM4EMAPTALDH1A1NPC1RAB9A
SCHEMBL2154993 0.83 LMNA (0.47) KDM4EMAPTALDH1A1NPC1RAB9A
SCHEMBL4956022 0.83 KDM4E (0.48) KDM4EMAPTALDH1A1NPC1RAB9A
SCHEMBL27713626 0.81 LMNA (0.50) ALDH1A1NPC1RAB9AADAMTS4CYP3A4
SCHEMBL2156443 0.80 MAPT (0.45) KDM4EMAPTALDH1A1NPC1RAB9A
SCHEMBL2155580 0.77 MMP13 (0.55) KDM4EMAPTALDH1A1NPC1RAB9A
SCHEMBL16493548 0.77 ALDH1A1 (0.46) MAPTALDH1A1ADAMTS4CYP3A4MEN1
SCHEMBL2155583 0.76 MAPT (0.45) KDM4EMAPTALDH1A1NPC1RAB9A
SCHEMBL5507261 0.76 LMNA (0.43) MAPTALDH1A1ADAMTS4CYP3A4MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101124213-A Sulfonylamino cyclic derivatives and uses thereof SERONO LAB (CH) 2008-02-13 CN claimed
EP-1828160-B1 SULFONYL AMINO CYCLIC DERIVATIVES AND USE THEREOF AS MMP INHIBITORS MERCK SERONO SA (CH) 2011-12-14 EP disclosed
US-20080194520-A1 Sulfonyl Amino Cyclic Derivatives and Use Thereof MERCK SERONO SA (CH) 2008-08-14 US disclosed
CN-101124213-A Sulfonylamino cyclic derivatives and uses thereof SERONO LAB (CH) 2008-02-13 CN 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-20080194520-A1 Sulfonyl Amino Cyclic Derivatives and Use Thereof GLS2, SRM, GLS KDM4E 1965/4885MAPT 4423/4885ALDH1A1 2059/4885

“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.