SCHEMBL26317481

SCHEMBL26317481

CCc1ccc(Nc2cc(CN(C)Cc3ccccc3)nc(N)n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.45
CYP2D6 P10635 1/20 0.45
AGPAT2 O15120 3/20 0.40
BCHE P06276 1/20 0.39
ACHE P22303 1/20 0.39
MAPT P10636 4/20 0.39
LMNA P02545 2/20 0.39
RXFP1 Q9HBX9 2/20 0.39
GHSR Q92847 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
KDM4E B2RXH2 1/20 0.38
POLB P06746 1/20 0.38
TSHR P16473 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
NPC1 O15118 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
RAB9A P51151 1/20 0.38
ROCK2 O75116 1/20 0.37
ROCK1 Q13464 1/20 0.37

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
SCHEMBL20339039 0.89 CYP1A2 (0.49) CYP1A2CYP2D6AGPAT2MAPTLMNA
SCHEMBL24019171 0.88 AGPAT2 (0.54) CYP1A2CYP2D6AGPAT2MAPTLMNA
SCHEMBL29621980 0.88 AGPAT2 (0.54) CYP1A2CYP2D6AGPAT2MAPTLMNA
SCHEMBL21530423 0.86 RAB9A (0.54) CYP1A2CYP2D6BCHEACHEMAPT
SCHEMBL26318052 0.86 DHFR (0.44) CYP1A2CYP2D6AGPAT2ACHEMAPT
SCHEMBL20340282 0.85 RAB9A (0.44) CYP1A2CYP2D6AGPAT2MAPTLMNA
SCHEMBL20339002 0.85 ABCG2 (0.47) CYP1A2CYP2D6AGPAT2
SCHEMBL29621826 0.83 ROCK1 (0.50) ACHEMAPTSMN1; SMN2POLBNPC1
SCHEMBL24019179 0.83 ROCK1 (0.50) ACHEMAPTSMN1; SMN2POLBNPC1
SCHEMBL21530477 0.83 CYP1A2 (0.47) CYP1A2CYP2D6MAPTLMNASMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11739072-B2 Heteroaryl compounds and their use MINORYX THERAPEUTICS S.L. (ES) 2023-08-29 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-11739072-B2 Heteroaryl compounds and their use GBA1, GBA2, GAA CYP1A2 815/4885CYP2D6 892/4885AGPAT2 309/4885

“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.