SCHEMBL7447683

SCHEMBL7447683

CCCCCCNc1ccccn1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX12 P18054 1/20 0.60
CYP2C19 P33261 1/20 0.57
CYP1A2 P05177 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.53
HTT P42858 1/20 0.53
CXCR4 P61073 1/20 0.50
DRD2 P14416 2/20 0.49
ADRA1A P35348 2/20 0.49
DRD3 P35462 2/20 0.49
SOAT1 P35610 2/20 0.49
S1PR2 O95136 1/20 0.49
LMNA P02545 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
HCAR3 P49019 1/20 0.49
FABP1 P07148 1/20 0.49
FABP6 P51161 1/20 0.49
DNM2 P50570 4/20 0.48
TLR8 Q9NR97 2/20 0.46

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
SCHEMBL28020759 1.00 ALOX12 (0.60) ALOX12CYP2C19CYP1A2SMN1; SMN2HTT
SCHEMBL31066860 1.00 ALOX12 (0.60) ALOX12CYP2C19CYP1A2SMN1; SMN2HTT
SCHEMBL11124152 1.00 ALOX12 (0.60) ALOX12CYP2C19CYP1A2SMN1; SMN2HTT
SCHEMBL28020389 1.00 ALOX12 (0.60) ALOX12CYP2C19CYP1A2SMN1; SMN2HTT
SCHEMBL10606557 1.00 ALOX12 (0.60) ALOX12CYP2C19CYP1A2SMN1; SMN2HTT
SCHEMBL10607875 1.00 ALOX12 (0.60) ALOX12CYP2C19CYP1A2SMN1; SMN2HTT
SCHEMBL31066872 1.00 ALOX12 (0.60) ALOX12CYP2C19CYP1A2SMN1; SMN2HTT
SCHEMBL30205633 1.00 ALOX12 (0.60) ALOX12CYP2C19CYP1A2SMN1; SMN2HTT
SCHEMBL1573818 1.00 ALOX12 (0.60) ALOX12CYP2C19CYP1A2SMN1; SMN2HTT
SCHEMBL28054301 1.00 ALOX12 (0.60) ALOX12CYP2C19CYP1A2SMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210238153-A2 RIP1 INHIBITORY COMPOUNDS AND METHODS FOR MAKING AND USING THE SAME RIGEL PHARMACEUTICALS, INC. (US) 2021-08-05 US disclosed
CN-108473484-A Compounds useful as TRPM8 modulators 赛诺米克斯公司 2018-08-31 CN disclosed
EP-0977743-A1 PROTEASE INHIBITORS Smithkline Beecham (US) 2000-02-09 EP disclosed
WO-1998049152-A1 PROTEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 1998-11-05 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-20210238153-A2 RIP1 INHIBITORY COMPOUNDS AND METHODS FOR MAKING AND USING THE SAME RIPK1, RIPK2, RIPK3 ALOX12 2560/4885CYP2C19 4876/4885CYP1A2 4865/4885

“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.