SCHEMBL26414566

SCHEMBL26414566

c1ccc(-c2c3ccccc3c(-c3ccc4c(c3)sc3cc5ccccc5cc34)c3ccccc23)c(-c2cccc3ccccc23)c1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 1/20 0.35
CA12 O43570 6/20 0.34
CA1 P00915 6/20 0.34
CA2 P00918 6/20 0.34
CA9 Q16790 6/20 0.34
PIM1 P11309 2/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MCL1 Q07820 2/20 0.33
ALOX5 P09917 2/20 0.33
ACMSD Q8TDX5 1/20 0.33
GPR84 Q9NQS5 1/20 0.32
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31

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
SCHEMBL17247099 0.94 SOS1 (0.36) SOS1CA12CA1CA2CA9
SCHEMBL27301591 0.93 CA12 (0.36) CA12CA1CA2CA9PIM1
SCHEMBL17944432 0.93 CA12 (0.35) SOS1CA12CA1CA2CA9
SCHEMBL19082110 0.92 SOS1 (0.35) SOS1CA12CA1CA2CA9
SCHEMBL22708250 0.92 ALDH1A1 (0.41) SOS1CA12CA1CA2CA9
SCHEMBL17247124 0.91 CA12 (0.36) SOS1CA12CA1CA2CA9
SCHEMBL17944382 0.91 SOS1 (0.36) SOS1CA12CA1CA2CA9
SCHEMBL17247104 0.90 CA12 (0.40) CA12CA1CA2CA9ALDH1A1
SCHEMBL19082256 0.90 CA12 (0.36) SOS1CA12CA1CA2CA9
SCHEMBL17944527 0.90 ALDH1A1 (0.35) SOS1CA12CA1CA2CA9

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-20230320214-A1 ORGANIC LIGHT-EMITTING DEVICE INCLUDING ORGANIC COMPOUND LG CHEM, LTD. (KR) 2023-10-05 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-20230320214-A1 ORGANIC LIGHT-EMITTING DEVICE INCLUDING ORGANIC COMPOUND CYP1A1, AOX1, CYP1B1 SOS1 47/4885CA12 1977/4885CA1 2963/4885

“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.