SCHEMBL2956799

SCHEMBL2956799

Cc1c(Cl)cccc1S(=O)(=O)N1CCN(C2(C)CC2)CC1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 3/20 0.52
HSD11B1 P28845 10/20 0.47
TSHR P16473 1/20 0.47
LMNA P02545 1/20 0.46
KMT2A Q03164 1/20 0.46
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
DCTPP1 Q9H773 1/20 0.44
HSD11B2 P80365 1/20 0.43
CHRM4 P08173 1/20 0.43

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
SCHEMBL2956787 0.87 CCR1 (0.65) CCR1TSHRLMNAKMT2AMAPK1
SCHEMBL1299167 0.82 TSHR (0.68) HSD11B1TSHRLMNAKMT2AMAPT
SCHEMBL2953584 0.80 CCR1 (0.67) CCR1LMNAMAPT
SCHEMBL2954368 0.77 MEN1 (0.56) KMT2AMAPT
SCHEMBL2962437 0.77 KMT2A (0.64) CCR1HSD11B1TSHRLMNAKMT2A
SCHEMBL5323326 0.74 HSD11B1 (0.42) HSD11B1TSHRLMNAKMT2AMAPT
SCHEMBL2963536 0.73 PKM (0.64) CCR1TSHR
SCHEMBL4004295 0.73 TSHR (0.52) HSD11B1TSHRLMNAKMT2AMAPT
SCHEMBL2963400 0.73 ABL1 (0.52) CCR1HSD11B1TSHRLMNAKMT2A
SCHEMBL2953590 0.73 EPHX2 (0.47) CCR1TSHRLMNAKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7759339-B2 Hydroxysteroid dehydrogenase inhibitors TAKEDA SAN DIEGO, INC. (US) 2010-07-20 US claimed
EP-1866298-A2 HYDROXYSTEROID DEHYDROGENASE INHIBITORS Takeda San Diego, Inc. (US) 2007-12-19 EP claimed
WO-2006105127-A2 HYDROXYSTEROID DEHYDROGENASE INHIBITORS TAKEDA SAN DIEGO, INC. (US) 2006-10-05 WO claimed
US-20060223829-A1 Hydroxysteroid dehydrogenase inhibitors TAKEDA SAN DIEGO, INC. 2006-10-05 US claimed
US-7759339-B2 Hydroxysteroid dehydrogenase inhibitors TAKEDA SAN DIEGO, INC. (US) 2010-07-20 US disclosed
US-7759339-B2 Hydroxysteroid dehydrogenase inhibitors TAKEDA SAN DIEGO, INC. (US) 2010-07-20 US disclosed
US-7759339-B2 Hydroxysteroid dehydrogenase inhibitors TAKEDA SAN DIEGO, INC. (US) 2010-07-20 US disclosed
EP-1866298-A2 HYDROXYSTEROID DEHYDROGENASE INHIBITORS Takeda San Diego, Inc. (US) 2007-12-19 EP disclosed
WO-2006105127-A2 HYDROXYSTEROID DEHYDROGENASE INHIBITORS TAKEDA SAN DIEGO, INC. (US) 2006-10-05 WO disclosed
US-20060223829-A1 Hydroxysteroid dehydrogenase inhibitors TAKEDA SAN DIEGO, INC. 2006-10-05 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-20060223829-A1 Hydroxysteroid dehydrogenase inhibitors HSD17B1, HSD17B3, HSD17B2 CCR1 4518/4885HSD11B1 7/4885TSHR 3888/4885

“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.