SCHEMBL20411983

SCHEMBL20411983

CCCc1ccc2cc(CCC)ncc2c1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 2/20 0.40
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
BDKRB2 P30411 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP2A6 P11509 1/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
CYP3A4 P08684 1/20 0.37
TSHR P16473 1/20 0.37
CTSS P25774 1/20 0.36
CTSK P43235 1/20 0.36
NCEH1 Q6PIU2 2/20 0.36
BACE1 P56817 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SIGMAR1 Q99720 1/20 0.34

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
SCHEMBL7193556 0.80 CNR1 (0.54) CNR1CNR2BDKRB2CYP1A2CYP2A6
SCHEMBL31593166 0.80 CNR1 (0.54) CNR1CNR2BDKRB2CYP1A2CYP2A6
SCHEMBL6114924 0.79 ATM (0.57) PDE10AATML3MBTL1CYP1A2CYP2A6
SCHEMBL803215 0.78 CYP1A2 (0.53) PDE10AATML3MBTL1CYP1A2CYP2A6
SCHEMBL14418568 0.77 CNR1 (0.44) CNR1CNR2CYP1A2CYP2A6NCEH1
SCHEMBL3671594 0.74 CYP1A2 (0.64) CNR1CNR2BDKRB2CYP1A2CYP2A6
SCHEMBL19068793 0.74 RAB9A (0.39) CNR1CNR2CYP1A2CYP2A6LMNA
SCHEMBL31349743 0.73 CYP19A1 (0.51) PDE10ACNR1CNR2BDKRB2CYP1A2
SCHEMBL6114451 0.73 CYP19A1 (0.51) PDE10ACNR1CNR2BDKRB2CYP1A2
SCHEMBL6114835 0.73 CYP19A1 (0.51) CNR1CNR2L3MBTL1CYP1A2CYP2A6

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-20180212165-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2018-07-26 US disclosed
US-20180212165-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2018-07-26 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-20180212165-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES TPR, TPO, DDT PDE10A 2504/4885CNR1 4564/4885CNR2 4409/4885

“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.