SCHEMBL6439299

SCHEMBL6439299

CCOC(=O)c1ccc(C2CCCCO2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.55
CYP2C9 P11712 2/20 0.55
CYP2C19 P33261 2/20 0.55
NPC1 O15118 2/20 0.55
CYP1A2 P05177 2/20 0.55
TP53 P04637 1/20 0.55
HPGD P15428 1/20 0.55
MAPT P10636 2/20 0.50
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
ESR1 P03372 1/20 0.47
CA7 P43166 1/20 0.47
CA9 Q16790 1/20 0.47
ESR2 Q92731 1/20 0.47
CA14 Q9ULX7 1/20 0.47
LMNA P02545 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAOA P21397 1/20 0.46
FDFT1 P37268 1/20 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
SCHEMBL1499458 0.82 CA1 (0.56) RAB9ACYP2C9CYP2C19NPC1CYP1A2
SCHEMBL23662444 0.80 NPC1 (0.58) RAB9ACYP2C9CYP2C19NPC1CYP1A2
SCHEMBL15654561 0.78 RAB9A (0.53) RAB9ACYP2C9CYP2C19NPC1CYP1A2
SCHEMBL28042573 0.78 TAAR1 (0.52)
SCHEMBL1789154 0.78 ALDH1A1 (0.63) RAB9ANPC1CYP1A2MAPTCA12
SCHEMBL730751 0.77 PRKAG1 (0.48) TP53HPGDKMT2APOLB
SCHEMBL7189606 0.77 PRKAG1 (0.43) KMT2A
SCHEMBL13374166 0.76 CYP2C9 (0.49) CYP2C9HPGD
SCHEMBL14966307 0.76 RAB9A (0.42) RAB9ACYP2C9CYP2C19NPC1CYP1A2
SCHEMBL4003420 0.76 CA12 (0.59) RAB9ACYP2C9NPC1CYP1A2HPGD

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-6867323-B2 Cross-coupling reaction of organosilicon nucleophiles THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2005-03-15 US disclosed
US-20020183516-A1 Cross-coupling reaction of organosilicon nucleophiles UNIVERSITY OF ILLINOIS URBANA-CHAMPAIGN 2002-12-05 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-20020183516-A1 Cross-coupling reaction of organosilicon nucleophiles TST, HPD, PCNA RAB9A 1546/4885CYP2C9 2121/4885CYP2C19 1856/4885

“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.