SCHEMBL17816408

SCHEMBL17816408

C=C(CCCCC)CC1CCCCC1=O

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
GAA P10253 1/20 0.39
KDM4E B2RXH2 1/20 0.38
NAAA Q02083 2/20 0.36
CA1 P00915 3/20 0.36
CA2 P00918 3/20 0.36
CA4 P22748 3/20 0.36
CA6 P23280 2/20 0.36
CCR2 P41597 1/20 0.35
LMNA P02545 1/20 0.34
KMT2A Q03164 1/20 0.33

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
SCHEMBL3470155 0.83 NPC1 (0.45) NPC1RAB9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL8239668 0.75 CA1 (0.42) NPC1RAB9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL536549 0.75 NPC1 (0.48) NPC1RAB9ASMN1; SMN2ALDH1A1HPGD
Formic Acid SCHEMBL28186935 0.75 NPC1 (0.46) NPC1RAB9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL25688171 0.74 CA1 (0.45) NPC1RAB9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL25688174 0.74 CA1 (0.45) NPC1RAB9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL14343841 0.74 CA1 (0.45) NPC1RAB9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL1278415 0.74 CA1 (0.45) NPC1RAB9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL25688169 0.74 CA1 (0.45) NPC1RAB9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL25688168 0.74 CA1 (0.45) NPC1RAB9ASMN1; SMN2ALDH1A1HPGD

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-20160159934-A1 USES OF CERTAIN PLATINOID ACCUMULATING PLANTS FOR USE IN ORGANIC CHEMICAL REACTIONS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S) (FR) 2016-06-09 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-20160159934-A1 USES OF CERTAIN PLATINOID ACCUMULATING PLANTS FOR USE IN ORGANIC CHEMICAL REACTIONS OAT, PPA1, ITPA NPC1 3641/4885RAB9A 4079/4885SMN1; SMN2 4134/4885

“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.