SCHEMBL24348809

SCHEMBL24348809

Cc1cc(Cc2ccccc2)ncn1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 1/20 0.41
CALM1 P0DP23 1/20 0.41
POLB P06746 1/20 0.41
ALDH1A1 P00352 4/20 0.40
TDP1 Q9NUW8 2/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TAAR1 Q96RJ0 1/20 0.39
TSHR P16473 2/20 0.38
IDH1 O75874 1/20 0.37
MAPK1 P28482 2/20 0.37
ALOX15 P16050 1/20 0.37
HSD17B10 Q99714 1/20 0.37
MAOB P27338 1/20 0.37
LMNA P02545 1/20 0.37
HPGD P15428 1/20 0.37
HTT P42858 1/20 0.37
BRD4 O60885 2/20 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
SCHEMBL415622 0.86 CALM1 (0.50) HTR2BCALM1POLBALDH1A1TDP1
SCHEMBL752939 0.83 KCNH2 (0.47) ALDH1A1MAPK1MAOBLMNAHPGD
SCHEMBL13098271 0.80 NOS3 (0.50) ALDH1A1L3MBTL1ALOX15HPGD
SCHEMBL27615865 0.80 SMN1; SMN2 (0.49) RAB9ASMN1; SMN2HTT
SCHEMBL3923373 0.77 BCL2 (0.44) HTR2BCALM1ALDH1A1TDP1RAB9A
SCHEMBL20348519 0.77 LOXL2 (0.43) HTR2BCALM1ALDH1A1TDP1RAB9A
SCHEMBL3913251 0.77 ALDH1A1 (0.52) HTR2BCALM1POLBALDH1A1TDP1
SCHEMBL23020320 0.76 MIF (0.52) HTR2BCALM1ALDH1A1TDP1RAB9A
SCHEMBL24076907 0.74 CYP2A6 (0.31)
SCHEMBL27585477 0.74 HTR2B (0.40) HTR2BCALM1POLBALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11773065-B2 Heterocyclic g-protein-coupled receptor 52 (GPR52) agonists BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2023-10-03 US disclosed
US-20220112164-A1 HETEROCYCLIC G-PROTEIN-COUPLED RECEPTOR 52 (GPR52) AGONISTS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2022-04-14 US disclosed
US-9040529-B2 4-phenylamino-pyrimidine derivatives having protein kinase inhibitor activity VICHEM CHEMIE KUTATÓ KFT. (HU) 2015-05-26 US disclosed
US-20120258968-A1 4-PHENYLAMINO-PYRIMIDINE DERIVATIVES HAVING PROTEIN KINASE INHIBITOR ACTIVITY VIROSTATICS S.R.L. (IT) 2012-10-11 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 (3 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-20220112164-A1 HETEROCYCLIC G-PROTEIN-COUPLED RECEPTOR 52 (GPR52) AGONISTS GPR52, GPR68, GPR65 HTR2B 131/4885CALM1 2096/4885POLB 4818/4885
US-20120258968-A1 4-PHENYLAMINO-PYRIMIDINE DERIVATIVES HAVING PROTEIN KINASE INHIBITOR ACTIVITY CDK9, CDK19, CDKL3 HTR2B 2879/4885CALM1 1348/4885POLB 1020/4885
US-11773065-B2 Heterocyclic g-protein-coupled receptor 52 (GPR52) agonists GPR52, GPR68, GPR65 HTR2B 131/4885CALM1 2096/4885POLB 4818/4885

“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.