SCHEMBL25856456

SCHEMBL25856456

Cc1cc(C(F)(F)F)c(CC#N)c(C(F)(F)F)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.39
KDM4E B2RXH2 7/20 0.38
GLA P06280 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
KMT2A Q03164 4/20 0.36
MEN1 O00255 3/20 0.36
BRCA1 P38398 1/20 0.36
HPGD P15428 4/20 0.36
HSD17B10 Q99714 3/20 0.36
HTT P42858 6/20 0.34
ALDH1A1 P00352 5/20 0.34
LMNA P02545 2/20 0.34
PKM P14618 1/20 0.34
TP53 P04637 1/20 0.34
TSHR P16473 1/20 0.34
GAA P10253 1/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33
HDAC1 Q13547 1/20 0.33

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
SCHEMBL24146516 0.82 ALDH1A1 (0.34) L3MBTL1KDM4ECYP1A2KMT2AMEN1
SCHEMBL25990991 0.81 AR (0.34) KDM4EGLAKMT2AMEN1HPGD
SCHEMBL25826316 0.77 AR (0.40) KDM4EGLAKMT2AMEN1HPGD
SCHEMBL25856471 0.75 KDM4E (0.31) KDM4EALDH1A1LMNA
SCHEMBL25908872 0.71 AR (0.40) KDM4EGLACYP1A2CYP2C19KMT2A
SCHEMBL24146619 0.71 AR (0.38) GAAAR
SCHEMBL24786242 0.71 RXRA (0.33) AR
SCHEMBL26312439 0.70 AR (0.36) KDM4EGLAHPGDALDH1A1TP53
SCHEMBL24168466 0.70 RXRA (0.34) L3MBTL1HTTLMNAPOLBNCOA1
SCHEMBL24136236 0.70 KDM4E (0.34) KDM4EALDH1A1

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-20230240139-A1 Organic Compound of Formula (I) for Use in Organic Electronic Devices, a Composition Comprising a Compound of Formula (IV) and at Least One Compound of Formula (IVa) to (IVd), an Organic Semiconductor Layer Comprising the Compound or Composition, an Organic Electronic Device Comprising the Organic Semiconductor Layer, and a Display Device Comprising the Organic Electronic Device NOVALED GMBH (DE) 2023-07-27 US disclosed
US-20230227401-A1 Organic Compound of Formula (I) for Use in Organic Electronic Devices, a Composition Comprising a Compound of Formula (IV) and at Least One Compound of Formula (IVa) to (IVd), an Organic Semiconductor Layer Comprising the Compound or Composition, an Organic Electronic Device Comprising the Organic Semiconductor Layer, and a Display Device Comprising the Organic Electronic Device NOVALED GMBH (DE) 2023-07-20 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 (2 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-20230240139-A1 Organic Compound of Formula (I) for Use in Organic Electronic Devices, a Composition Comprising a Compound of Formula (IV) and at Least One Compound of Formula (IVa) to (IVd), an Organic Semiconductor Layer Comprising the Compound or Composition, an Organic Electronic Device Comprising the Organic Semiconductor Layer, and a Display Device Comprising the Organic Electronic Device CFD, OCIAD2, OCIAD1 L3MBTL1 4348/4885KDM4E 1247/4885GLA 2729/4885
US-20230227401-A1 Organic Compound of Formula (I) for Use in Organic Electronic Devices, a Composition Comprising a Compound of Formula (IV) and at Least One Compound of Formula (IVa) to (IVd), an Organic Semiconductor Layer Comprising the Compound or Composition, an Organic Electronic Device Comprising the Organic Semiconductor Layer, and a Display Device Comprising the Organic Electronic Device CFD, OCIAD2, OCIAD1 L3MBTL1 4348/4885KDM4E 1247/4885GLA 2729/4885

“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.