SCHEMBL7545166

SCHEMBL7545166

O=Cc1ccc(C(=O)Nc2cccc3ccccc23)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.71
RAB9A P51151 4/20 0.71
CYP1A2 P05177 2/20 0.71
CYP3A4 P08684 2/20 0.71
CYP2D6 P10635 2/20 0.71
CYP2C19 P33261 2/20 0.71
CYP2C9 P11712 1/20 0.71
KMT2A Q03164 3/20 0.63
EGFR P00533 1/20 0.56
ERBB2 P04626 1/20 0.56
KDM4E B2RXH2 2/20 0.54
GAA P10253 2/20 0.54
GRIN2D O15399 1/20 0.54
GRIN2C Q14957 1/20 0.54
ALOX5 P09917 1/20 0.53
HSD17B10 Q99714 1/20 0.53
ALDH1A1 P00352 2/20 0.50
LMNA P02545 2/20 0.50
POLB P06746 2/20 0.50
MAPT P10636 2/20 0.50

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
SCHEMBL26885232 0.84 NPC1 (0.81) NPC1RAB9ACYP1A2CYP3A4CYP2D6
SCHEMBL30184438 0.84 NPC1 (1.00) NPC1RAB9ACYP1A2CYP3A4CYP2D6
SCHEMBL4642544 0.84 NPC1 (1.00) NPC1RAB9ACYP1A2CYP3A4CYP2D6
SCHEMBL3659724 0.83 RAB9A (0.84) NPC1RAB9ACYP1A2CYP3A4CYP2D6
SCHEMBL7539037 0.83 NPC1 (0.78) NPC1RAB9ACYP1A2CYP3A4CYP2D6
SCHEMBL24799860 0.82 RAB9A (0.68) NPC1RAB9ACYP1A2CYP3A4CYP2D6
SCHEMBL30735621 0.81 RAB9A (0.76) NPC1RAB9ACYP1A2CYP3A4CYP2D6
SCHEMBL3679744 0.81 RAB9A (0.76) NPC1RAB9ACYP1A2CYP3A4CYP2D6
SCHEMBL29124091 0.81 NPC1 (0.76) NPC1RAB9ACYP1A2CYP3A4CYP2D6
SCHEMBL27447692 0.81 NPC1 (0.76) NPC1RAB9ACYP1A2CYP3A4CYP2D6

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-20020094993-A1 Compositions for repelling crawling insects S.C. JOHNSON & SON, INC. 2002-07-18 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-20020094993-A1 Compositions for repelling crawling insects ACHE, DDT, GAP43 NPC1 4384/4885RAB9A 1587/4885CYP1A2 1275/4885

“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.