SCHEMBL29313341

SCHEMBL29313341

C=C/C=C\c1c(C)c(-c2ccc(-c3ccccc3)cc2)c2ccccc2c1-c1cccc2oc3ccccc3c12

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
POLB P06746 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP1A1 P04798 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP1B1 Q16678 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30

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
SCHEMBL23813096 0.89 PLA2G2A (0.35) MEN1NPC1POLBKMT2ACYP1A1
SCHEMBL23746758 0.89 CDC14B (0.31) CA1CA2
SCHEMBL29313369 0.88 ALOX5 (0.39) PTPN1MEN1NPC1POLBKMT2A
SCHEMBL25640497 0.86 MEN1 (0.34) MEN1NPC1POLBKMT2ACYP1A1
SCHEMBL23746819 0.86
SCHEMBL23747011 0.85 ALDH1A1 (0.32)
SCHEMBL25640261 0.82 MAPT (0.36) CYP1A1CYP1A2CYP1B1
SCHEMBL29313372 0.82 ALOX5 (0.38) MEN1NPC1POLBKMT2ACYP1A1
SCHEMBL23426871 0.81 HSP90AA1 (0.31)
SCHEMBL23746947 0.81 HPGD (0.30)

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-20240228513-A1 ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO LTD (KR) 2024-07-11 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-20240228513-A1 ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES OR10J3, ORC3, C1R PTPN1 3635/4885MEN1 3685/4885NPC1 4161/4885

“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.