SCHEMBL17414871

SCHEMBL17414871

COc1ccc(N(c2ccc(OC)cc2)c2ccc3c(c2)c2cc(N(c4ccc(OC)cc4)c4ccc(OC)cc4)ccc2n3Cc2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 1/20 0.53
KMT2A Q03164 2/20 0.50
TSHR P16473 1/20 0.50
MAPK1 P28482 1/20 0.50
PLA2G2A P14555 13/20 0.49
PLA2G1B P04054 1/20 0.49
MAPT P10636 1/20 0.48
ALDH1A1 P00352 1/20 0.48
POLB P06746 1/20 0.48
HTT P42858 1/20 0.48
SIGMAR1 Q99720 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
SCHEMBL18084007 0.93 P2RX4 (0.54) P2RX4KMT2ATSHRMAPK1MAPT
SCHEMBL18083982 0.92 P2RX4 (0.47) P2RX4KMT2ATSHRMAPK1PLA2G2A
SCHEMBL18083995 0.90 P2RX4 (0.47) P2RX4KMT2ATSHRMAPK1PLA2G2A
SCHEMBL30822886 0.88 P2RX4 (0.45) P2RX4KMT2APLA2G2AMAPTALDH1A1
SCHEMBL18083987 0.88 P2RX4 (0.45) P2RX4KMT2APLA2G2AMAPTALDH1A1
SCHEMBL17449597 0.87 CYP19A1 (0.55) P2RX4KMT2AMAPK1MAPTALDH1A1
SCHEMBL29354558 0.87 CYP19A1 (0.55) P2RX4KMT2AMAPK1MAPTALDH1A1
SCHEMBL18083981 0.86 GRIK2 (0.43) P2RX4KMT2AMAPTALDH1A1POLB
SCHEMBL17965656 0.84 CYP19A1 (0.66) P2RX4KMT2AMAPK1MAPTALDH1A1
SCHEMBL19821768 0.84 P2RX4 (0.45) P2RX4KMT2ATSHRMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10403445-B2 Synthons for developing organic semiconductors UNIVERSITÉ DE TOURS (FR) 2019-09-03 US disclosed
US-10403445-B2 Synthons for developing organic semiconductors UNIVERSITÉ DE TOURS (FR) 2019-09-03 US disclosed
US-20170213652-A1 NOVEL SYNTHONS FOR DEVELOPING ORGANIC SEMICONDUCTORS UNIVERSITÉ DE TOURS (FR) 2017-07-27 US disclosed
US-20170213652-A1 NOVEL SYNTHONS FOR DEVELOPING ORGANIC SEMICONDUCTORS UNIVERSITÉ DE TOURS (FR) 2017-07-27 US disclosed
US-20170213652-A1 NOVEL SYNTHONS FOR DEVELOPING ORGANIC SEMICONDUCTORS UNIVERSITÉ DE TOURS (FR) 2017-07-27 US disclosed
WO-2016016221-A1 NOVEL SYNTHONS FOR DEVELOPING ORGANIC SEMICONDUCTORS UNIVERSITE DE TOURS FRANCOIS-RABELAIS (FR) 2016-02-04 WO disclosed
EP-2966145-A1 Carbazole based hole transport materials Dyenamo AB (SE) 2016-01-13 EP disclosed
EP-2966145-A1 Carbazole based hole transport materials Dyenamo AB (SE) 2016-01-13 EP 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-20170213652-A1 NOVEL SYNTHONS FOR DEVELOPING ORGANIC SEMICONDUCTORS NES, NCL, CDK6 P2RX4 4383/4885KMT2A 1940/4885TSHR 2309/4885
US-10403445-B2 Synthons for developing organic semiconductors NES, NCL, PCNA P2RX4 4205/4885KMT2A 2020/4885TSHR 1926/4885

“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.