SCHEMBL19731925

SCHEMBL19731925

CCCCc1cc(N)n(-c2ccc(O)cc2)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.46
CNR1 P21554 1/20 0.45
CNR2 P34972 1/20 0.45
ALOX5 P09917 1/20 0.43
ESR1 P03372 4/20 0.42
LMNA P02545 4/20 0.42
CYP1A2 P05177 3/20 0.42
CYP2C19 P33261 3/20 0.42
MAPK1 P28482 3/20 0.42
TP53 P04637 3/20 0.42
CYP3A4 P08684 3/20 0.42
MAPT P10636 2/20 0.42
CYP2C9 P11712 2/20 0.42
KMT2A Q03164 2/20 0.42
KDM4E B2RXH2 2/20 0.42
HIF1A Q16665 2/20 0.42
HSD17B10 Q99714 2/20 0.42
NFKB1 P19838 2/20 0.42
GMNN O75496 1/20 0.42
USP2 O75604 1/20 0.42

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
SCHEMBL2364213 0.87 NPC1 (0.53) CNR1CNR2ALOX5LMNACYP1A2
SCHEMBL27682759 0.85 NPC1 (0.49) CNR1CNR2ALOX5LMNACYP1A2
SCHEMBL27742972 0.85 NPC1 (0.51) CNR1CNR2ALOX5LMNACYP1A2
SCHEMBL27702016 0.85 CNR2 (0.48) CNR1CNR2ALOX5CYP1A2CYP2C19
SCHEMBL27742966 0.85 CNR1 (0.61) CNR1CNR2ALOX5LMNACYP1A2
SCHEMBL11687153 0.84 POLB (0.43) ESR1LMNACYP1A2CYP2C19MAPK1
Ammonia Solution, Strong SCHEMBL27702328 0.84 NPC1 (0.48) CNR1CNR2ALOX5LMNACYP1A2
SCHEMBL27795718 0.84 CNR1 (0.44) CNR1CNR2ALOX5CYP1A2CYP2C19
SCHEMBL27702044 0.84 CNR2 (0.46) CNR1CNR2ALOX5LMNACYP1A2
SCHEMBL19388963 0.83 PTGS1 (0.48) CNR1CNR2ALOX5TP53MAPT

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-10000471-B2 Pyrazole P38 map kinase inhibitors RESPIVERT LIMITED (GB) 2018-06-19 US disclosed
US-20170362208-A1 NOVEL COMPOUNDS RESPIVERT LIMITED (GB) 2017-12-21 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-20170362208-A1 NOVEL COMPOUNDS ARG1, IL1B, LTB4R MIF 816/4885CNR1 122/4885CNR2 303/4885
US-10000471-B2 Pyrazole P38 map kinase inhibitors MAPK1, MAP3K1, MAPK3 MIF 707/4885CNR1 1504/4885CNR2 1997/4885

“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.