SCHEMBL751889

SCHEMBL751889

COc1cc2c(cc1OC)C1(CC2(C)C)CC(C)(C)c2cc3c(cc21)Oc1cc2nc4cc5c(cc4nc2cc1O3)C(C)(C)CC51CC(C)(C)c2cc3nc4cc(C)c(C)cc4nc3cc21

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 5/20 0.36
NPC1 O15118 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
G6PD P11413 1/20 0.36
PKM P14618 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL25513983 0.94 NQO2 (0.33) NQO2NPC1LMNAPOLBMAPT
SCHEMBL12124204 0.94 NQO2 (0.33) NQO2NPC1LMNAPOLBMAPT
SCHEMBL20000005 0.92 NPC1 (0.30) NQO2NPC1LMNAPOLBMAPT
SCHEMBL13250932 0.88 FTO (0.33) MAPT
SCHEMBL19398982 0.85 KDM4E (0.36) NQO2MAPT
SCHEMBL15987275 0.85 KDM4E (0.36) NQO2MAPT
SCHEMBL19999999 0.80 AMY1A (0.33) NQO2NPC1LMNAPOLBMAPT
SCHEMBL12124175 0.79
SCHEMBL13250933 0.79
SCHEMBL10001255 0.79 FTO (0.40) MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11660575-B2 Reactive inhibition of pore structure collapse during pyrolytic formation of carbon molecular sieves ExxonMobil Technology and Engineering Company (US) 2023-05-30 US disclosed
US-20160367948-A1 CROSSLINKED POLYMER, METHOD FOR PRODUCING THE SAME, MOLECULAR SIEVE COMPOSITION AND MATERIAL SEPARATION MEMBRANES KYOTO UNIVERSITY (JP) 2016-12-22 US disclosed
US-9244008-B2 Surface plasmon resonance sensor element and sensor including the same 3M INNOVATIVE PROPERTIES COMPANY (US) 2016-01-26 US disclosed
US-8395086-B2 Heater device QINETIQ LIMITED (GB) 2013-03-12 US disclosed
US-8137979-B2 Preconcentrator device QINETIQ LIMITED (GB) 2012-03-20 US disclosed
US-8056732-B2 Microporous polymer material THE UNIVERSITY OF MANCHESTER (GB) 2011-11-15 US disclosed
US-20100304112-A1 MICROPOROUS POLYMER MATERIAL THE UNIVERSITY OF MANCHESTER (GB) 2010-12-02 US disclosed
US-20100144049-A1 PRECONCENTRATOR DEVICE INCORPORATING A POLYMER OF INTRINSIC MICROPOROSITY QINETIQ LIMITED (GB) 2010-06-10 US disclosed
US-20100130796-A1 HEATER SUITABLE FOR USE IN A PRECONCENTRATOR DEVICE QINETIQ LIMITED (GB) 2010-05-27 US disclosed
US-7690514-B2 Microporous polymer material THE UNIVERSITY OF MANCHESTER (GB) 2010-04-06 US disclosed
US-20090211336-A1 HEATER DEVICE QINETIQ LIMITED (GB) 2009-08-27 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 (2 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-20100130796-A1 HEATER SUITABLE FOR USE IN A PRECONCENTRATOR DEVICE PIEZO1, PIM1, PIM3 NQO2 1337/4885NPC1 2542/4885LMNA 1695/4885
US-11660575-B2 Reactive inhibition of pore structure collapse during pyrolytic formation of carbon molecular sieves PRF1, STOM, CYCS NQO2 3738/4885NPC1 2013/4885LMNA 371/4885

“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.