SCHEMBL17115776

SCHEMBL17115776

O=C(Nc1ccc(Nc2ccc(Nc3ccccc3)cc2)cc1)c1ccccc1F

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 1.00
RAB9A P51151 8/20 1.00
MEN1 O00255 6/20 1.00
KMT2A Q03164 6/20 1.00
TDP1 Q9NUW8 1/20 0.83
LMNA P02545 2/20 0.75
SMN1; SMN2 Q16637 8/20 0.71
HTT P42858 2/20 0.66
MAPT P10636 4/20 0.63
TP53 P04637 2/20 0.61
NFKB1 P19838 1/20 0.61
NFKB2 Q00653 1/20 0.61
RELA Q04206 1/20 0.61
POLB P06746 1/20 0.61
ALDH1A1 P00352 3/20 0.60
P4HTM Q9NXG6 1/20 0.60
MCL1 Q07820 1/20 0.60
KDM4E B2RXH2 1/20 0.60
RXFP1 Q9HBX9 1/20 0.58

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
SCHEMBL14825062 1.00 NPC1 (1.00) NPC1RAB9AMEN1KMT2ATDP1
SCHEMBL4363732 0.93 MEN1 (0.89) NPC1RAB9AMEN1KMT2ATDP1
SCHEMBL6814456 0.87 MEN1 (0.77) NPC1RAB9AMEN1KMT2ATDP1
SCHEMBL30739608 0.86 LMNA (1.00) NPC1RAB9AMEN1KMT2ATDP1
SCHEMBL6295702 0.86 LMNA (1.00) NPC1RAB9AMEN1KMT2ATDP1
SCHEMBL4102438 0.85 MEN1 (0.80) NPC1RAB9AMEN1KMT2ATDP1
SCHEMBL27471728 0.85 MEN1 (0.74) NPC1RAB9AMEN1KMT2ATDP1
SCHEMBL12189650 0.83 MEN1 (0.70) NPC1RAB9AMEN1KMT2ATDP1
SCHEMBL30799144 0.83 MEN1 (0.83) NPC1RAB9AMEN1KMT2ATDP1
SCHEMBL679040 0.83 MEN1 (0.83) NPC1RAB9AMEN1KMT2ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10720584-B2 Charge-transporting varnish, and organic electroluminescent element NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2020-07-21 US disclosed
US-10301484-B2 Varnish for formation of charge-transporting thin film NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2019-05-28 US disclosed
US-20180151805-A1 CHARGE-TRANSPORTING VARNISH, AND ORGANIC ELECTROLUMINESCENT ELEMENT NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2018-05-31 US disclosed
EP-3306692-A1 CHARGE-TRANSPORTING VARNISH, AND ORGANIC ELECTROLUMINESCENT ELEMENT Nissan Chemical Industries, Ltd. (JP) 2018-04-11 EP disclosed
EP-3252840-A1 VARNISH FOR FORMATION OF CHARGE-TRANSPORTING THIN FILM Nissan Chemical Industries, Ltd. (JP) 2017-12-06 EP disclosed
EP-3121163-A1 OLIGOANILINE DERIVATIVE, CHARGE-TRANSPORTING VARNISH, AND ORGANIC ELECTROLUMINESCENT ELEMENT Nissan Chemical Industries, Ltd. (JP) 2017-01-25 EP disclosed
WO-2016190326-A1 CHARGE-TRANSPORTING VARNISH, AND ORGANIC ELECTROLUMINESCENT ELEMENT 日産化学工業株式会社 2016-12-01 WO disclosed
WO-2016117521-A1 VARNISH FOR FORMATION OF CHARGE-TRANSPORTING THIN FILM 日産化学工業株式会社 2016-07-28 WO disclosed
WO-2015141585-A1 OLIGOANILINE DERIVATIVE, CHARGE-TRANSPORTING VARNISH, AND ORGANIC ELECTROLUMINESCENT ELEMENT 日産化学工業株式会社 2015-09-24 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 (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-10720584-B2 Charge-transporting varnish, and organic electroluminescent element SLCO4C1, SLCO2A1, SLCO1A2 NPC1 148/4885RAB9A 250/4885MEN1 2626/4885
US-20180151805-A1 CHARGE-TRANSPORTING VARNISH, AND ORGANIC ELECTROLUMINESCENT ELEMENT SLCO4C1, SLCO2A1, SLCO1A2 NPC1 148/4885RAB9A 250/4885MEN1 2626/4885

“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.