SCHEMBL3727243

SCHEMBL3727243

Nc1cccc(Cl)c1N1CCOCC1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
CNR2 P34972 7/20 0.47
CYP2A13 Q16696 3/20 0.46
ALDH1A1 P00352 1/20 0.42
KMT2A Q03164 1/20 0.42
RAD51 Q06609 1/20 0.41
LMNA P02545 1/20 0.41
P2RX7 Q99572 1/20 0.41
LGMN Q99538 1/20 0.41
KDM4E B2RXH2 1/20 0.41
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
DPP4 P27487 1/20 0.41

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
SCHEMBL22662669 0.83 KEAP1 (0.47) GAAMAPTSMN1; SMN2CNR2ALDH1A1
SCHEMBL5092052 0.81 KEAP1 (0.50) SMN1; SMN2CNR2ALDH1A1LMNAKDM4E
SCHEMBL29931924 0.81 KEAP1 (0.50) SMN1; SMN2CNR2ALDH1A1LMNAKDM4E
SCHEMBL4435301 0.80 LGMN (0.50) GAAMAPTSMN1; SMN2ALDH1A1KMT2A
Hydrochloric Acid SCHEMBL29978819 0.80 KEAP1 (0.48) GAAMAPTSMN1; SMN2CNR2ALDH1A1
Hydrochloric Acid SCHEMBL23043631 0.80 KEAP1 (0.48) GAAMAPTSMN1; SMN2CNR2ALDH1A1
SCHEMBL613154 0.79 ADRB1 (0.55) ALDH1A1
SCHEMBL13724280 0.79 AR (0.42) GAAMAPTSMN1; SMN2ALDH1A1KMT2A
SCHEMBL16943272 0.79 ALDH1A1 (0.47) SMN1; SMN2CNR2CYP2A13ALDH1A1LMNA
SCHEMBL3723928 0.79 ALDH1A1 (0.54) GAAMAPTCNR2CYP2A13ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230104936-A1 TRPML MODULATORS CASMA THERAPEUTICS, INC. 2023-04-06 US disclosed
EP-4076423-A1 TRPML MODULATORS Casma Therapeutics, Inc. (US) 2022-10-26 EP disclosed
CN-115087440-A TRPML modulators 卡斯玛治疗公司 2022-09-20 CN disclosed
WO-2021127337-A1 TRPML MODULATORS CASMA THERAPEUTICS, INC. (US) 2021-06-24 WO disclosed
WO-2010125103-A1 DIKETOPIPERAZINE DERIVATIVES AS P2X7 MODULATORS GLAXO GROUP LIMITED (GB) 2010-11-04 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-20230104936-A1 TRPML MODULATORS TRPM2, TRPM4, TRPM5 GAA 2832/4885MAPT 1167/4885SMN1; SMN2 1776/4885

“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.