SCHEMBL3635570

SCHEMBL3635570

CC(C)Cn1c(-c2cnc(Cl)c(Cl)c2)nc2cccc(Cl)c21

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 9/20 0.49
ALDH1A1 P00352 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CASR P41180 2/20 0.38
S1PR1 P21453 1/20 0.38
VDR P11473 1/20 0.36
NR1H4 Q96RI1 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
PRMT5 O14744 1/20 0.35
KDM4E B2RXH2 1/20 0.34
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL3636827 0.84 ALDH1A1 (0.48) GRM5ALDH1A1SMN1; SMN2CASRS1PR1
SCHEMBL3633793 0.84 GRM5 (0.66) GRM5ALDH1A1CASRPRMT5KDM4E
SCHEMBL3633413 0.81 GRM5 (0.78) GRM5
SCHEMBL3633417 0.79 GRM5 (0.60) GRM5SMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL3635880 0.79 GRM5 (0.46) GRM5ALDH1A1SMN1; SMN2S1PR1
SCHEMBL3635996 0.76 GRM5 (0.46) GRM5ALDH1A1SMN1; SMN2CASRS1PR1
SCHEMBL13872546 0.76 PRMT5 (0.44) ALDH1A1SMN1; SMN2S1PR1PRMT5KDM4E
SCHEMBL3637014 0.76 GRM5 (0.61) GRM5ALDH1A1SMN1; SMN2CASRVDR
SCHEMBL3635686 0.75 GRM5 (0.58) GRM5ALDH1A1SMN1; SMN2CASRVDR
SCHEMBL3635770 0.73 MEN1 (0.46) GRM5ALDH1A1SMN1; SMN2VDRNR1H4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2146969-A1 NICOTINIC ACID DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR-5 Novartis Ag (CH) 2010-01-27 EP disclosed
US-20090105266-A1 Organic compounds NOVARTIS AG (CH) 2009-04-23 US disclosed
WO-2008128968-A1 NICOTINIC ACID DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR-5 NOVARTIS AG (CH) 2008-10-30 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-20090105266-A1 Organic compounds SLCO2B1, SLCO1B1, SLCO1B3 GRM5 4545/4885ALDH1A1 45/4885SMN1; SMN2 3532/4885

“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.