SCHEMBL23536158

SCHEMBL23536158

Nc1cccc(F)c1N1CCC(CN2C3COCC2C3)CC1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.32
BPTF Q12830 1/20 0.32
C5AR1 P21730 2/20 0.31
PREP P48147 1/20 0.31
TRPA1 O75762 1/20 0.30
SLC6A2 P23975 1/20 0.30
KCNH2 Q12809 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
SCHEMBL29931942 1.00 GRM2 (0.32) GRM2BPTFC5AR1PREPTRPA1
SCHEMBL23536005 0.86 MEN1 (0.33) BPTFC5AR1TRPA1
SCHEMBL23536178 0.86 MEN1 (0.33) BPTFC5AR1TRPA1
SCHEMBL23536259 0.82 ALDH1A1 (0.36) GRM2
SCHEMBL29931820 0.82 ALDH1A1 (0.36) GRM2
SCHEMBL23536073 0.77 BPTF (0.34) GRM2BPTFTRPA1
SCHEMBL29932313 0.77 BPTF (0.34) GRM2BPTFTRPA1
SCHEMBL14804508 0.75 BPTF (0.38) BPTFPREP
SCHEMBL23535973 0.74 CYP2A13 (0.34) BPTF
SCHEMBL23536058 0.74 CYP2A13 (0.34) BPTF

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
US-20230104936-A1 TRPML MODULATORS CASMA THERAPEUTICS, INC. 2023-04-06 US 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

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 GRM2 190/4885BPTF 4279/4885C5AR1 3120/4885

“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.