SCHEMBL25878119

SCHEMBL25878119

CC(C)(C)c1ccc(-c2cccc3ncccc23)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.56
CA12 O43570 3/20 0.55
CA1 P00915 3/20 0.55
CA2 P00918 3/20 0.55
CA9 Q16790 3/20 0.55
KMT2A Q03164 2/20 0.53
MEN1 O00255 1/20 0.53
PABPC1 P11940 1/20 0.53
EIF4H Q15056 1/20 0.53
ACVR1 Q04771 3/20 0.49
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 1/20 0.46
KIF11 P52732 2/20 0.44
ERN1 O75460 3/20 0.43
MAPT P10636 1/20 0.42
SLC22A12 Q96S37 1/20 0.42
AAK1 Q2M2I8 1/20 0.42
TNKS O95271 1/20 0.41
TNKS2 Q9H2K2 1/20 0.41
AKT1 P31749 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
SCHEMBL28925687 0.89 KDR (0.48) KDRCA12CA1CA2CA9
SCHEMBL26050662 0.84 ACVR1 (0.50) KDRCA12CA1CA2CA9
SCHEMBL23796001 0.84 TOP1 (0.55) KDRCA12CA1CA2CA9
SCHEMBL12386951 0.81 CA12 (0.59) KDRCA12CA1CA2CA9
SCHEMBL10154084 0.80 ACVR1 (0.49) KDRCA12CA1CA2CA9
SCHEMBL23555710 0.80 CA12 (0.61) KDRCA12CA1CA2CA9
SCHEMBL12074247 0.80 CA12 (0.65) CA12CA1CA2CA9ACVR1
SCHEMBL4658401 0.79 CA12 (0.59) CA12CA1CA2CA9ACVR1
SCHEMBL28950128 0.79 NR1H4 (0.43) KDRKMT2AMEN1PABPC1EIF4H
SCHEMBL4073648 0.78 CA12 (0.59) CA12CA1CA2CA9ACVR1

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-20230192669-A1 COMPOUND, ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPARATUS SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-06-22 US disclosed
US-20230192669-A1 COMPOUND, ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPARATUS SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-06-22 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-20230192669-A1 COMPOUND, ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPARATUS ACHE, OR51E2, L1CAM KDR 2964/4885CA12 3640/4885CA1 3329/4885

“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.