SCHEMBL22760890

SCHEMBL22760890

Cc1cc(C)cc(-c2ccc3c4ccccc4n(-c4cc(C#N)cc(-n5c6ccccc6c6ccc(-c7cc(C)cc(C)c7)cc65)c4-c4cccc(C#N)c4)c3c2)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A3 P47895 1/20 0.36
GRM5 P41594 1/20 0.34
SYK P43405 1/20 0.34
GRIA2 P42262 1/20 0.34
GRIA4 P48058 1/20 0.34
ALDH1A1 P00352 4/20 0.33
CYP1A2 P05177 4/20 0.33
CYP3A4 P08684 3/20 0.33
CLK4 Q9HAZ1 3/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
CYP2C19 P33261 2/20 0.33
PGR P06401 2/20 0.33
LMNA P02545 2/20 0.33
TSHR P16473 2/20 0.33
HSD17B10 Q99714 2/20 0.33
MAPK1 P28482 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
IRAK4 Q9NWZ3 1/20 0.33

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
SCHEMBL21546984 0.96 GRM5 (0.37) ALDH1A3GRM5SYKGRIA2GRIA4
SCHEMBL22760889 0.94 ALDH1A3 (0.37) ALDH1A3GRM5SYKGRIA2GRIA4
SCHEMBL21546477 0.92 MCHR1 (0.37) ALDH1A3GRIA2GRIA4ALDH1A1CYP1A2
SCHEMBL21546788 0.92 ALDH1A3 (0.37) ALDH1A3GRM5GRIA2GRIA4ALDH1A1
SCHEMBL21546578 0.92 ALDH1A3 (0.38) ALDH1A3GRM5GRIA2GRIA4ALDH1A1
SCHEMBL21546619 0.91 ALDH1A3 (0.34) ALDH1A3GRIA2GRIA4ALDH1A1CYP1A2
SCHEMBL21931693 0.91 ALDH1A3 (0.36) ALDH1A3GRM5SYKALDH1A1CYP1A2
SCHEMBL22761228 0.90 SYK (0.39) ALDH1A3GRM5SYKARPTPN5
SCHEMBL21546759 0.90 ALDH1A3 (0.39) ALDH1A3GRIA2GRIA4ALDH1A1CYP1A2
SCHEMBL21546620 0.90 CYP1A2 (0.39) ALDH1A3GRM5SYKGRIA2GRIA4

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-10981930-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2021-04-20 US disclosed
US-20200385399-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2020-12-10 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-10981930-B2 Organic molecules for use in optoelectronic devices OR10J3, OR51E2, EPCAM ALDH1A3 39/4885GRM5 3532/4885SYK 1131/4885
US-20200385399-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OR10J3, OR51E2, EPCAM ALDH1A3 39/4885GRM5 3532/4885SYK 1131/4885

“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.