SCHEMBL24634296

SCHEMBL24634296

c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cccc5cc6ccccc6cc45)cc3)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA9 Q16790 2/20 0.40
TNF P01375 1/20 0.40
HSD17B1 P14061 1/20 0.40
HSD17B2 P37059 1/20 0.40
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
MPI P34949 1/20 0.39
KMT2A Q03164 1/20 0.39
GPR84 Q9NQS5 2/20 0.37
PPARG P37231 7/20 0.36
PPARA Q07869 7/20 0.36
PTGS2 P35354 1/20 0.36
CYP2C19 P33261 2/20 0.35
CYP2C9 P11712 1/20 0.35

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
SCHEMBL5552277 0.95 ALDH1A1 (0.38) CA12CA1CA2CA9TNF
SCHEMBL31534001 0.95 ALDH1A1 (0.38) CA12CA1CA2CA9TNF
SCHEMBL27546117 0.93 ALDH1A1 (0.37) CA12CA1CA2CA9TNF
SCHEMBL10022923 0.91 ALDH1A1 (0.41) CA12CA1CA2CA9TNF
SCHEMBL29703107 0.91 HSD17B1 (0.39) CA12CA1CA2CA9TNF
SCHEMBL5713441 0.89 TNF (0.47) CA12CA1CA2CA9TNF
Biphenyl SCHEMBL27587049 0.89 TNF (0.47) CA12CA1CA2CA9TNF
SCHEMBL10246863 0.89 GSTP1 (0.37) CA12CA1CA2CA9TNF
SCHEMBL17443013 0.88 TNF (0.46) CA12CA1CA2CA9TNF
Biphenyl SCHEMBL27655664 0.88 TNF (0.48) CA12CA1CA2CA9TNF

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-20220275008-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2022-09-01 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-20220275008-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE OCIAD2, OCIAD1, OXER1 CA12 737/4885CA1 2509/4885CA2 1860/4885

“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.