SCHEMBL9634997

SCHEMBL9634997

COc1cccc(OC)c1N(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.52
CA2 P00918 4/20 0.52
CA7 P43166 3/20 0.52
CA9 Q16790 3/20 0.52
CA12 O43570 2/20 0.52
CA14 Q9ULX7 2/20 0.52
CA4 P22748 1/20 0.52
ALDH1A1 P00352 3/20 0.46
TP53 P04637 2/20 0.46
MAPK1 P28482 2/20 0.46
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
ALOX15 P16050 1/20 0.46
ALOX12 P18054 1/20 0.46
HSD17B10 Q99714 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.43
CHRM2 P08172 1/20 0.43

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
SCHEMBL18509715 0.86 CA1 (0.44) CA1CA2CA7CA9CA12
SCHEMBL18716623 0.84 ALDH1A1 (0.56) CA1CA2CA7CA9CA12
SCHEMBL21737252 0.80 DRD2 (0.41) CA2CA9CA12CYP3A4MAPT
SCHEMBL24655960 0.80 AR (0.41) CA1CA2CA7CA9CA12
SCHEMBL12861290 0.78 SMN1; SMN2 (0.49) CA1CA2CA7CA9CA12
SCHEMBL7166858 0.77 CA1 (0.50) CA1CA2CA7CA9CA12
SCHEMBL24317923 0.77 CA1 (0.44) CA1CA2CA7CA9CA12
SCHEMBL24315696 0.77 CA12 (0.44) CA1CA2CA7CA9CA12
SCHEMBL15883218 0.75 TP53 (0.51) CA1CA2CA7CA9CA12
SCHEMBL12861334 0.74 CYP3A4 (0.49) CA1CA2CA7CA9CA12

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0280975-B1 PROCESSES FOR THE PRODUCTION OF SUBSTITUTED BENZALDEHYDES, AND INTERMEDIATE PRODUCTS OBTAINED BY THESE PROCESSES F. HOFFMANN-LA ROCHE AG (CH) 1992-07-08 EP claimed
EP-0280975-A1 Processes for the production of substituted benzaldehydes, and intermediate products obtained by these processes F. HOFFMANN-LA ROCHE AG (CH) 1988-09-07 EP claimed
US-20230339902-A1 TRICYCLIC LIGANDS FOR DEGRADATION OF IKZF2 OR IKZF4 C4 THERAPEUTICS, INC. (US) 2023-10-26 US disclosed
US-20230339902-A1 TRICYCLIC LIGANDS FOR DEGRADATION OF IKZF2 OR IKZF4 C4 THERAPEUTICS, INC. (US) 2023-10-26 US disclosed
US-20230002430-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-01-05 US disclosed
US-9988369-B2 Heterocyclic triazole compounds as agonists of the APJ receptor AMGEN INC. (US) 2018-06-05 US disclosed
US-20170320860-A1 HETEROCYCLIC TRIAZOLE COMPOUNDS AS AGONISTS OF THE APJ RECEPTOR AMGEN INC. 2017-11-09 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 (3 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-20230339902-A1 TRICYCLIC LIGANDS FOR DEGRADATION OF IKZF2 OR IKZF4 IKZF1, IKZF3, IKZF2 CA1 4365/4885CA2 4527/4885CA7 4563/4885
US-20230002430-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES CHRM1, L1CAM, SOD1 CA1 1559/4885CA2 3653/4885CA7 3306/4885
US-20170320860-A1 HETEROCYCLIC TRIAZOLE COMPOUNDS AS AGONISTS OF THE APJ RECEPTOR TBXA2R, APLNR, AGTR1 CA1 4635/4885CA2 2954/4885CA7 4406/4885

“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.