SCHEMBL23876376

SCHEMBL23876376

O=c1[nH]c2cc(I)ccc2c2ccccc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 15/20 0.62
KDM4E B2RXH2 2/20 0.62
MEN1 O00255 2/20 0.62
CYP1A2 P05177 2/20 0.62
KMT2A Q03164 2/20 0.62
TNKS O95271 1/20 0.62
ALDH1A1 P00352 1/20 0.62
LMNA P02545 1/20 0.62
GPR3 P46089 1/20 0.62
BLM P54132 1/20 0.62
PMP22 Q01453 1/20 0.62
PARP15 Q460N3 1/20 0.62
HSD17B10 Q99714 1/20 0.62
TNKS2 Q9H2K2 1/20 0.62
CSNK2A1 P68400 1/20 0.50
CASP7 P55210 1/20 0.50
CASP6 P55212 1/20 0.50
CASP8 Q14790 1/20 0.50
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44

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
SCHEMBL26383576 0.85 PARP1 (0.64) PARP1KDM4EMEN1CYP1A2KMT2A
SCHEMBL1278345 0.80 AHR (0.64) KDM4EALDH1A1LMNAGPR3HSD17B10
SCHEMBL12330378 0.78 GAA (0.67) KDM4EMEN1KMT2AALDH1A1LMNA
SCHEMBL26560322 0.78 KIF11 (0.67) PARP1KDM4EMEN1CYP1A2KMT2A
SCHEMBL6651281 0.78 PARP1 (0.79) PARP1KDM4EMEN1CYP1A2KMT2A
SCHEMBL26775706 0.78 PARP1 (0.63) PARP1KDM4EMEN1CYP1A2KMT2A
SCHEMBL20227729 0.78 PARP1 (0.62) PARP1KDM4EMEN1CYP1A2KMT2A
SCHEMBL17293 0.78 PARP1 (1.00) PARP1KDM4EMEN1CYP1A2KMT2A
SCHEMBL29593478 0.78 PARP1 (1.00) PARP1KDM4EMEN1CYP1A2KMT2A
SCHEMBL31326568 0.78 PARP1 (1.00) PARP1KDM4EMEN1CYP1A2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230337537-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES UDC IRELAND LIMITED (IE) 2023-10-19 US disclosed
US-20230337537-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES UDC IRELAND LIMITED (IE) 2023-10-19 US disclosed
WO-2021191058-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2021-09-30 WO 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-20230337537-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES L1CAM, PIEZO1, GPX1 PARP1 1558/4885KDM4E 3275/4885MEN1 362/4885

“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.