SCHEMBL21473789

SCHEMBL21473789

Cc1ccc(Cc2ccc(-c3ccc(Cc4ccccn4)cc3)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.57
SYK P43405 3/20 0.51
NPSR1 Q6W5P4 1/20 0.51
AURKB Q96GD4 1/20 0.50
INCENP Q9NQS7 1/20 0.50
KDM4E B2RXH2 1/20 0.50
MAPT P10636 1/20 0.50
KEAP1 Q14145 1/20 0.48
NFE2L2 Q16236 1/20 0.48
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
ALDH1A1 P00352 2/20 0.44
HRH3 Q9Y5N1 1/20 0.43
GRIN1 Q05586 1/20 0.42
GRIN2B Q13224 1/20 0.42
LMNA P02545 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
ALOX15 P16050 1/20 0.42
CYP3A4 P08684 1/20 0.41

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
SCHEMBL8736874 0.93 L3MBTL1 (0.65) L3MBTL1SYKNPSR1AURKBINCENP
SCHEMBL118923 0.85 L3MBTL1 (0.65) L3MBTL1KDM4EMAPTNPC1RAB9A
Toluene SCHEMBL28430347 0.80 L3MBTL1 (0.54) L3MBTL1NPSR1KDM4EMAPTKEAP1
SCHEMBL2760129 0.78 L3MBTL1 (0.65) L3MBTL1NPSR1KDM4EMAPTNPC1
SCHEMBL18557437 0.78 L3MBTL1 (0.56) L3MBTL1NPSR1KDM4EMAPTKEAP1
SCHEMBL23894333 0.77 CALM1 (0.57) L3MBTL1KDM4EMAPTNPC1RAB9A
SCHEMBL8752792 0.77 MEN1 (0.51) KDM4ENPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL64435 0.77 L3MBTL1 (0.68) L3MBTL1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL29373231 0.77 L3MBTL1 (0.68) L3MBTL1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL27635619 0.77 CALM1 (0.57) L3MBTL1KDM4EMAPTNPC1RAB9A

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 L3MBTL1 900/4885SYK 1664/4885NPSR1 3109/4885
US-11512039-B2 Aromatic amine derivatives, preparation methods therefor, and uses thereof SLC7A1, WEE1, SLC7A5 L3MBTL1 900/4885SYK 1664/4885NPSR1 3109/4885

“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.