SCHEMBL22402289

SCHEMBL22402289

Cc1ccc(-c2c(C)c(=O)n(COCC[Si](C)(C)C)c(=O)n2C)c(C)c1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.36
DRD1 P21728 3/20 0.32
CRHR1 P34998 2/20 0.32
HPGD P15428 2/20 0.32
MAPK1 P28482 2/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
DGAT1 O75907 1/20 0.31
TSHR P16473 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
TP53 P04637 1/20 0.30
RAB9A P51151 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
SCHEMBL30864167 0.89 NPC1 (0.35) NPC1
SCHEMBL16337243 0.89 NPC1 (0.37) NPC1DRD1MAPT
SCHEMBL16334924 0.89 NPC1 (0.35) NPC1
SCHEMBL20610856 0.88 CRHR1 (0.38) NPC1DRD1CRHR1DGAT1
SCHEMBL16363024 0.85 KDM4E (0.35) NPC1DRD1HPGDALDH1A1
SCHEMBL30362407 0.84 NPC1 (0.36) NPC1DRD1
SCHEMBL16338010 0.84 NPC1 (0.36) NPC1DRD1
SCHEMBL16337404 0.82 DGAT1 (0.41) NPC1HPGDALDH1A1DGAT1L3MBTL1
SCHEMBL16336781 0.82 DRD1 (0.35) NPC1DRD1DGAT1
SCHEMBL16337072 0.78 DRD1 (0.57) NPC1DRD1ALDH1A1DGAT1SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11014909-B2 Heteroaromatic compounds and their use as dopamine D1 ligands PFIZER INC. (US) 2021-05-25 US disclosed
US-20200283407-A1 HETEROAROMATIC COMPOUNDS AND THEIR USE AS DOPAMINE D1 LIGANDS PFIZER (US) 2020-09-10 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 (2 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-20200283407-A1 HETEROAROMATIC COMPOUNDS AND THEIR USE AS DOPAMINE D1 LIGANDS DRD2, DRD1, SNCA NPC1 840/4885DRD1 2/4885CRHR1 300/4885
US-11014909-B2 Heteroaromatic compounds and their use as dopamine D1 ligands DRD2, DRD1, SNCA NPC1 840/4885DRD1 2/4885CRHR1 300/4885

“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.