SCHEMBL2217032

SCHEMBL2217032

C[C@@H](NCc1csc(-c2ccc(Cl)cc2)n1)c1cccc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GFER P55789 1/20 0.47
CASR P41180 2/20 0.44
MAPT P10636 4/20 0.43
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
RAB9A P51151 1/20 0.43
KMT2A Q03164 1/20 0.43
HIF1A Q16665 1/20 0.43
HSD17B10 Q99714 1/20 0.43
RHOC P08134 1/20 0.41
RHOA P61586 1/20 0.41
HPGD P15428 1/20 0.40
TP53 P04637 3/20 0.40
ACP3 P15309 1/20 0.40

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
SCHEMBL15653639 1.00 GFER (0.47) GFERCASRMAPTMEN1NPC1
SCHEMBL2219210 0.91 HPGD (0.49) CASRNPC1ALDH1A1RAB9AHPGD
SCHEMBL12513730 0.90 CASR (0.45) CASRMAPTALDH1A1HPGD
SCHEMBL15653617 0.80 GFER (0.47) GFERMAPTMEN1NPC1ALDH1A1
SCHEMBL2219204 0.80 GFER (0.47) GFERMAPTMEN1NPC1ALDH1A1
SCHEMBL15654005 0.77 MAPT (0.52) GFERMAPTMEN1NPC1ALDH1A1
SCHEMBL2215734 0.77 MAPT (0.52) GFERMAPTMEN1NPC1ALDH1A1
SCHEMBL3657245 0.73 HPGD (0.56) CASRNPC1ALDH1A1RAB9AHPGD
SCHEMBL2217384 0.73 HPGD (0.56) CASRNPC1ALDH1A1RAB9AHPGD
SCHEMBL2457307 0.72 CASR (0.42) CASRMAPTCYP2D6TP53ACP3

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
EP-2212284-B1 CALCIUM RECEPTOR MODULATING AGENTS AMGEN INC (US) 2014-04-30 EP claimed
US-8334317-B2 Calcium receptor modulating agents AMGEN INC. (US) 2012-12-18 US claimed
US-20110178133-A1 CALCIUM RECEPTOR MODULATING AGENTS AMGEN INC. 2011-07-21 US claimed
EP-2212284-B1 CALCIUM RECEPTOR MODULATING AGENTS AMGEN INC (US) 2014-04-30 EP disclosed
US-8334317-B2 Calcium receptor modulating agents AMGEN INC. (US) 2012-12-18 US disclosed
US-8334317-B2 Calcium receptor modulating agents AMGEN INC. (US) 2012-12-18 US disclosed
US-20110178133-A1 CALCIUM RECEPTOR MODULATING AGENTS AMGEN INC. 2011-07-21 US disclosed
US-20110178133-A1 CALCIUM RECEPTOR MODULATING AGENTS AMGEN INC. 2011-07-21 US disclosed
WO-2009051718-A2 CALCIUM RECEPTOR MODULATING AGENTS AMGEN INC. (US) 2009-04-23 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-20110178133-A1 CALCIUM RECEPTOR MODULATING AGENTS CASR, CALCR, RYR1 GFER 2135/4885CASR 1/4885MAPT 2589/4885

“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.