SCHEMBL21473873

SCHEMBL21473873

Cc1ccc2ccc(C)c(N(c3ccc(C(C)C)cc3)c3cc(C)c4ccc5c(N(c6ccc(C(C)C)cc6)c6c(C)ccc7ccc(C)cc67)cc(C)c6ccc3c4c65)c2c1

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2A6 P11509 1/20 0.31
PBK Q96KB5 2/20 0.30
ALDH1A1 P00352 2/20 0.30
GAA P10253 2/20 0.30
MEN1 O00255 1/20 0.30
MAPK1 P28482 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
KDM4E B2RXH2 1/20 0.30
HPGD P15428 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL21475617 0.91 CYP1A2 (0.30) CYP1A2CYP2A6
SCHEMBL17680051 0.83 LMNA (0.36) LMNAPBKALDH1A1GAAMEN1
SCHEMBL24699792 0.80 CYP2A6 (0.33) CYP1A2CYP2A6
SCHEMBL25965705 0.79 AKR1B1 (0.33) CYP1A2CYP2A6ALDH1A1GAA
SCHEMBL21475599 0.79 CYP1A2 (0.31) CYP1A2CYP2A6
SCHEMBL17680049 0.78 LMNA (0.34) LMNA
SCHEMBL21475604 0.76
SCHEMBL24699027 0.76
SCHEMBL21475602 0.75 LMNA (0.30) LMNASMN1; SMN2
SCHEMBL21475606 0.74

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-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 (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-20190315675-A1 AROMATIC AMINE DERIVATIVES, PREPARATION METHODS THEREFOR, AND USES THEREOF SLC7A1, WEE1, SLC7A5 LMNA 1379/4885CYP1A2 733/4885CYP2A6 2010/4885

“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.