SCHEMBL26344805

SCHEMBL26344805

CCc1cnc(-c2ccc(C)cc2)cc1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 1/20 0.50
NOS1 P29475 1/20 0.50
NOS2 P35228 1/20 0.50
LDHA P00338 1/20 0.42
ADORA3 P0DMS8 3/20 0.40
SREBF1 P36956 1/20 0.39
SREBF2 Q12772 1/20 0.39
MEN1 O00255 1/20 0.39
TP53 P04637 1/20 0.39
KMT2A Q03164 1/20 0.39
RAD51 Q06609 1/20 0.38
ADORA1 P30542 2/20 0.38
METAP2 P50579 1/20 0.38
METAP1 P53582 1/20 0.38
GAA P10253 1/20 0.38
CCR1 P32246 1/20 0.38
CCR5 P51681 1/20 0.38
CCR8 P51685 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
PLK1 P53350 1/20 0.38

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
SCHEMBL18729640 0.86 LDHA (0.58) NOS3NOS1NOS2LDHAMEN1
SCHEMBL7203119 0.82 NOS3 (0.63) NOS3NOS1NOS2LDHACCR1
SCHEMBL22549187 0.81 KDM1A (0.38) LDHAMEN1TP53KMT2AMETAP2
SCHEMBL22994424 0.81 LDHA (0.36) LDHAMEN1TP53KMT2AMETAP2
SCHEMBL25472652 0.81 KDM1A (0.38) LDHAMEN1TP53KMT2AMETAP2
SCHEMBL22951161 0.79 NOS3 (0.47) NOS3NOS1NOS2LDHATP53
SCHEMBL18729621 0.79 CCR1 (0.44) NOS3NOS1NOS2LDHAMEN1
SCHEMBL21888832 0.77 LDHA (0.46) NOS3NOS1NOS2LDHAADORA3
SCHEMBL24701802 0.77 SYK (0.38) LDHAMEN1KMT2AKDM1AAURKB
SCHEMBL18729745 0.76 LDHA (0.40) LDHAMEN1TP53KMT2AMETAP2

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-20230345811-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-10-26 US disclosed
US-20230303601-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-09-28 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-20230303601-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES MGLL, SELENOI, APOL1 NOS3 1404/4885NOS1 1822/4885NOS2 1821/4885
US-20230345811-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OPRD1, L1CAM, OPRM1 NOS3 2364/4885NOS1 3055/4885NOS2 3504/4885

“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.