SCHEMBL22870543

SCHEMBL22870543

OC1(c2ccc(Cl)cc2)CCCCCCCCCCC1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.64
OPRM1 P35372 2/20 0.56
OPRL1 P41146 2/20 0.56
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
SLC6A4 P31645 7/20 0.52
SLC6A3 Q01959 7/20 0.52
SLC18A3 Q16572 1/20 0.51
CCR3 P51677 1/20 0.50
OPRD1 P41143 1/20 0.49
OPRK1 P41145 1/20 0.49
HSD11B1 P28845 5/20 0.47
SLC6A2 P23975 2/20 0.47
HDAC4 P56524 1/20 0.47

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
SCHEMBL8986023 1.00 DRD2 (0.64) DRD2OPRM1OPRL1MEN1KMT2A
SCHEMBL16249345 0.93 DRD2 (0.67) DRD2OPRM1OPRL1MEN1KMT2A
SCHEMBL29090112 0.88 DRD2 (0.72) DRD2OPRM1OPRL1MEN1KMT2A
SCHEMBL654604 0.81 DRD2 (0.86) DRD2OPRM1OPRL1MEN1KMT2A
SCHEMBL6752708 0.79 ESR1 (0.64) DRD2OPRM1OPRL1MEN1KMT2A
SCHEMBL6058583 0.79 ESR1 (0.64) DRD2OPRM1MEN1KMT2ASLC6A4
SCHEMBL216848 0.78 DRD2 (0.60) DRD2OPRM1OPRL1MEN1KMT2A
SCHEMBL17186803 0.78 DRD2 (0.60) DRD2OPRM1OPRL1MEN1KMT2A
SCHEMBL187716 0.78 DRD2 (1.00) DRD2OPRM1OPRL1MEN1KMT2A
SCHEMBL24845287 0.78 DRD2 (0.43) DRD2OPRM1OPRL1SLC6A4SLC6A3

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-20210005814-A1 MATERIAL FOR HOLE-TRANSPORT LAYER, MATERIAL FOR HOLE-INJECTION LAYER, ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, LIGHT-EMITTING APPARATUS, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2021-01-07 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-20210005814-A1 MATERIAL FOR HOLE-TRANSPORT LAYER, MATERIAL FOR HOLE-INJECTION LAYER, ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, LIGHT-EMITTING APPARATUS, ELECTRONIC DEVICE, AND LIGHTING DEVICE SLC18A1, AOC3, HTR3D DRD2 39/4885OPRM1 191/4885OPRL1 88/4885

“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.