SCHEMBL22802126

SCHEMBL22802126

COc1ccc(Nc2ccccc2)cc1-c1ccnn1C(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 4/20 0.42
HTR2C P28335 4/20 0.42
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
ALOX15 P16050 1/20 0.38
CYP2C19 P33261 1/20 0.38
HSD17B10 Q99714 1/20 0.38
FGFR2 P21802 1/20 0.38
BRD4 O60885 1/20 0.38
CSNK2A1 P68400 1/20 0.38
STK10 O94804 1/20 0.38
SLK Q9H2G2 1/20 0.38
APP P05067 1/20 0.37
MAPT P10636 1/20 0.37
GALR2 O43603 1/20 0.36
GALR1 P47211 1/20 0.36

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
SCHEMBL5063258 0.77 HTR2A (0.62) HTR2AHTR2CMEN1KMT2ALMNA
SCHEMBL5578134 0.77 KDM4C (0.41) HTR2AHTR2CMEN1KMT2ALMNA
SCHEMBL29573188 0.75 HTR2A (0.67) HTR2AHTR2C
SCHEMBL5057269 0.75 HTR2A (0.75) HTR2AHTR2C
SCHEMBL29573411 0.75 HTR2A (0.75) HTR2AHTR2C
SCHEMBL22802125 0.75 KIT (0.41) MEN1KMT2AHSD17B10MAPTNR3C2
SCHEMBL29573185 0.74 HTR2A (0.60) HTR2AHTR2CMEN1KMT2AMAPT
SCHEMBL5063292 0.74 HTR2A (0.60) HTR2AHTR2CMEN1KMT2AMAPT
SCHEMBL5946686 0.72 HTR2A (0.73) HTR2AHTR2CMAPT
SCHEMBL29573160 0.72 HTR2A (0.61) HTR2AHTR2CMEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200397755-A1 DIARYL AND ARYLHETEROARYL UREA DERIVATIVES AS MODULATORS OF THE 5-HT2A SEROTONIN RECEPTOR USEFUL FOR THE PROPHYLAXIS AND TREATMENT OF DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC. 2020-12-24 US 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-20200397755-A1 DIARYL AND ARYLHETEROARYL UREA DERIVATIVES AS MODULATORS OF THE 5-HT2A SEROTONIN RECEPTOR USEFUL FOR THE PROPHYLAXIS AND TREATMENT OF DISORDERS RELATED THERETO HTR5A, HTR2A, HTR2C HTR2A 2/4885HTR2C 3/4885MEN1 4602/4885

“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.