SCHEMBL7535968

SCHEMBL7535968

CCOC(=O)NCc1ccccc1C=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.45
ALDH1A1 P00352 4/20 0.45
NPC1 O15118 3/20 0.45
CYP1A2 P05177 2/20 0.45
CYP2C19 P33261 2/20 0.45
RAB9A P51151 2/20 0.45
TSHR P16473 1/20 0.44
GAA P10253 3/20 0.43
ALOX15 P16050 1/20 0.42
HPGD P15428 3/20 0.41
KDM4E B2RXH2 2/20 0.41
GLA P06280 1/20 0.41
POLB P06746 1/20 0.41
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC11 Q96DB2 1/20 0.40

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
SCHEMBL15738726 0.86 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1NPC1CYP1A2CYP2C19
SCHEMBL7535934 0.84 SMN1; SMN2 (0.38) SMN1; SMN2ALDH1A1NPC1CYP1A2CYP2C19
SCHEMBL5705169 0.81 TSHR (0.49) SMN1; SMN2ALDH1A1NPC1CYP1A2CYP2C19
SCHEMBL28333253 0.81 HPGD (0.58) SMN1; SMN2ALDH1A1NPC1RAB9ATSHR
SCHEMBL28716737 0.81 GAA (0.51) SMN1; SMN2ALDH1A1NPC1RAB9ATSHR
SCHEMBL29501769 0.81 GAA (0.51) SMN1; SMN2ALDH1A1NPC1RAB9ATSHR
SCHEMBL19126687 0.81 KCNA5 (0.49) POLBHDAC1HDAC10HDAC6LMNA
SCHEMBL6696629 0.80 KMT2A (0.45) ALDH1A1NPC1CYP1A2CYP2C19RAB9A
SCHEMBL7538476 0.80 TSHR (0.48) SMN1; SMN2ALDH1A1TSHRGAAALOX15
SCHEMBL6331300 0.78 NPC1 (0.62) SMN1; SMN2ALDH1A1NPC1RAB9ATSHR

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 SMN1; SMN2 2971/4885ALDH1A1 1488/4885NPC1 4384/4885

“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.