SCHEMBL21473900

SCHEMBL21473900

Cc1ccc2ccc(C)c(N(c3ccc4ccc5c(N(c6c(C)ccc7ccc(C)cc67)c6cccc7c6oc6ccccc67)ccc6ccc3c4c65)c3cccc4c3oc3ccccc34)c2c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.34
CYP2A6 P11509 1/20 0.34
MAOB P27338 2/20 0.33
MAOA P21397 2/20 0.33
MAPT P10636 2/20 0.32
NPC1 O15118 2/20 0.32
POLB P06746 2/20 0.32
ALDH1A1 P00352 3/20 0.32
HPGD P15428 3/20 0.32
HSD17B10 Q99714 2/20 0.32
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
RAB9A P51151 2/20 0.32
KMT2A Q03164 1/20 0.32
KDM4E B2RXH2 1/20 0.31
GAA P10253 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL24728519 0.92 ALDH1A1 (0.37) CYP1A2CYP2A6MAOAMAPTNPC1
SCHEMBL23919408 0.90 ALDH1A1 (0.36) ALDH1A1HPGDHSD17B10CYP3A4TSHR
SCHEMBL17676445 0.89 HPGD (0.33) CYP1A2CYP2A6MAOBMAOAMAPT
SCHEMBL12206527 0.89 HPGD (0.34) ALDH1A1HPGDHSD17B10CYP3A4TSHR
SCHEMBL17676448 0.88 LMNA (0.34) CYP1A2CYP2A6MAOBMAOAMAPT
SCHEMBL23919425 0.87 MAPT (0.33) MAOBMAOAMAPTNPC1POLB
SCHEMBL21475609 0.86 ALOX5 (0.32) CYP1A2CYP2A6MAPTPOLBALDH1A1
SCHEMBL21473902 0.86 CYP1A2 (0.30) CYP1A2CYP2A6MAOB
SCHEMBL21475610 0.86 CYP1A2 (0.34) CYP1A2CYP2A6MAOBMAPTALDH1A1
SCHEMBL23131471 0.86 HPGD (0.33) ALDH1A1HPGDHSD17B10CYP3A4TSHR

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-11512039-B2 Aromatic amine derivatives, preparation methods therefor, and uses thereof GUANGZHOU CHINARAY OPTOELECTRONIC MATERIALS LTD. (CN) 2022-11-29 US disclosed
US-20190315675-A1 AROMATIC AMINE DERIVATIVES, PREPARATION METHODS THEREFOR, AND USES THEREOF GUANGZHOU CHINARAY OPTOELECTRONIC MATERIALS LTD. (CN) 2019-10-17 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-20190315675-A1 AROMATIC AMINE DERIVATIVES, PREPARATION METHODS THEREFOR, AND USES THEREOF SLC7A1, WEE1, SLC7A5 CYP1A2 733/4885CYP2A6 2010/4885MAOB 36/4885
US-11512039-B2 Aromatic amine derivatives, preparation methods therefor, and uses thereof SLC7A1, WEE1, SLC7A5 CYP1A2 733/4885CYP2A6 2010/4885MAOB 36/4885

“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.