SCHEMBL23536397

SCHEMBL23536397

COCSc1ccc(CBr)cc1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.37
ALDH1A1 P00352 3/20 0.36
TRPA1 O75762 1/20 0.36
TSHR P16473 1/20 0.36
MAOA P21397 3/20 0.34
MAOB P27338 3/20 0.34
SLC6A4 P31645 6/20 0.32
KDM4E B2RXH2 3/20 0.31
CES2 O00748 1/20 0.31
CES1 P23141 1/20 0.31
CYP4F2 P78329 1/20 0.30
CYP4A11 Q02928 1/20 0.30
PKM P14618 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL23393800 0.82 ALDH1A1 (0.39) APPALDH1A1TRPA1TSHRMAOA
SCHEMBL23536313 0.81 DAO (0.40) APPTSHRMAOAMAOBSLC6A4
SCHEMBL1684523 0.78 MAOA (0.48) ALDH1A1MAOAMAOBSMN1; SMN2
SCHEMBL8881477 0.76 KDM4E (0.42) ALDH1A1TSHRKDM4E
SCHEMBL24894090 0.74 CYP3A4 (0.44) ALDH1A1TSHRMAOAKDM4E
SCHEMBL12557496 0.74 KDM4E (0.32) APPALDH1A1MAOASLC6A4KDM4E
SCHEMBL2647401 0.73 CA2 (0.47) ALDH1A1TSHRKDM4E
SCHEMBL942119 0.73 ALDH1A1 (0.52) ALDH1A1TSHRMAOAMAOBSMN1; SMN2
SCHEMBL10731219 0.72 ALDH1A1 (0.40) APPALDH1A1MAOAMAOBKDM4E
SCHEMBL2646823 0.72 CYP4F2 (0.54) ALDH1A1KDM4ECYP4F2CYP4A11SMN1; SMN2

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-2021127337-A1 TRPML MODULATORS CASMA THERAPEUTICS, INC. (US) 2021-06-24 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 APP 2651/4885ALDH1A1 3737/4885TRPA1 13/4885

“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.