SCHEMBL757150

SCHEMBL757150

CC(C)(C)[C@H]1COC(c2cccc(-c3cccc4ccccc34)n2)=N1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.49
MAPT P10636 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
RAB9A P51151 1/20 0.49
ALOX15 P16050 10/20 0.38
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 3/20 0.36
HPGD P15428 2/20 0.36
CNR2 P34972 1/20 0.35
ENPP3 O14638 1/20 0.34
ENPP1 P22413 1/20 0.34
TP53 P04637 1/20 0.33
MAPK1 P28482 1/20 0.33
HSD17B10 Q99714 1/20 0.33
HTR2C P28335 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
SCHEMBL14154783 0.86 CNR2 (0.42) NPC1MAPTSMN1; SMN2RAB9AKDM4E
SCHEMBL28485532 0.86 CNR2 (0.42) NPC1MAPTSMN1; SMN2RAB9AKDM4E
SCHEMBL14821169 0.86 CNR2 (0.42) NPC1MAPTSMN1; SMN2RAB9AKDM4E
Hydrochloric Acid SCHEMBL7176559 0.83 CNR2 (0.41) NPC1MAPTSMN1; SMN2RAB9AKDM4E
Hydrochloric Acid SCHEMBL7176423 0.83 CNR2 (0.41) NPC1MAPTSMN1; SMN2RAB9AKDM4E
Hydrochloric Acid SCHEMBL7176684 0.83 CNR2 (0.41) NPC1MAPTSMN1; SMN2RAB9AKDM4E
Hydrochloric Acid SCHEMBL7183257 0.83 CNR2 (0.41) NPC1MAPTSMN1; SMN2RAB9AKDM4E
Hydrochloric Acid SCHEMBL7183592 0.83 CNR2 (0.41) NPC1MAPTSMN1; SMN2RAB9AKDM4E
Hydrochloric Acid SCHEMBL7180528 0.83 CNR2 (0.41) NPC1MAPTSMN1; SMN2RAB9AKDM4E
SCHEMBL757124 0.81 RAB9A (0.46) NPC1MAPTSMN1; SMN2RAB9AALDH1A1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8138348-B2 Using coordination polymerization catalyst EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-03-20 US disclosed
US-8138348-B2 Using coordination polymerization catalyst EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-03-20 US disclosed
US-20080182989-A1 Methods For Oligomerizing Olefins With Chromium Pyridine Mono-Oxazoline Catalysts EXXONMOBIL CHEMICAL PATENTS INC. 2008-07-31 US disclosed
US-20080182989-A1 Methods For Oligomerizing Olefins With Chromium Pyridine Mono-Oxazoline Catalysts EXXONMOBIL CHEMICAL PATENTS INC. 2008-07-31 US disclosed
WO-2008085655-A1 METHODS FOR OLIGOMERIZING OLEFINS WITH CHROMIUM PYRIDINE MONO-OXAZOLINE CATALYSTS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2008-07-17 WO 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-20080182989-A1 Methods For Oligomerizing Olefins With Chromium Pyridine Mono-Oxazoline Catalysts OXER1, OXGR1, OXA1L NPC1 3998/4885MAPT 2924/4885SMN1; SMN2 1823/4885

“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.