SCHEMBL16801876

SCHEMBL16801876

O=c1oc2ccc(Br)cc2c2ccccc12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.64
▸ RAB9A P51151 2/20 0.64
▸ SMN1; SMN2 Q16637 2/20 0.64
▸ KMT2A Q03164 2/20 0.64
▸ MAPK1 P28482 1/20 0.64
▸ GABRP O00591 3/20 0.53
▸ GABRD O14764 3/20 0.53
▸ GABRA1 P14867 3/20 0.53
▸ GABRB1 P18505 3/20 0.53
▸ GABRG2 P18507 3/20 0.53
▸ GABRB3 P28472 3/20 0.53
▸ GABRA5 P31644 3/20 0.53
▸ GABRA3 P34903 3/20 0.53
▸ GABRA2 P47869 3/20 0.53
▸ GABRB2 P47870 3/20 0.53
▸ GABRA4 P48169 3/20 0.53
▸ GABRE P78334 3/20 0.53
▸ GABRA6 Q16445 3/20 0.53
▸ GABRG1 Q8N1C3 3/20 0.53
▸ GABRG3 Q99928 3/20 0.53

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
SCHEMBL31511489 0.87 NPSR1 (0.53) NPC1RAB9ASMN1; SMN2KMT2AMAPK1
SCHEMBL17637791 0.87 NPSR1 (0.53) NPC1RAB9ASMN1; SMN2KMT2AMAPK1
SCHEMBL10357156 0.87 NPSR1 (0.53) NPC1RAB9ASMN1; SMN2KMT2AMAPK1
SCHEMBL16797962 0.85 NPSR1 (0.64) NPC1RAB9ASMN1; SMN2KMT2AMAPK1
SCHEMBL67700 0.80 MAPT (0.59) NPC1RAB9ASMN1; SMN2KMT2AGABRP
SCHEMBL635182 0.80 MAPT (0.59) NPC1RAB9ASMN1; SMN2KMT2AGABRP
SCHEMBL29886872 0.80 MAPT (0.59) NPC1RAB9ASMN1; SMN2KMT2AGABRP
SCHEMBL16925876 0.80 ESR2 (0.52) SMN1; SMN2KMT2AMAPK1CA9CA12
SCHEMBL21824208 0.79 GABRP (0.46) NPC1RAB9ASMN1; SMN2KMT2AMAPK1
SCHEMBL6255392 0.78 NPC1 (1.00) NPC1RAB9ASMN1; SMN2KMT2AMAPK1

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230217811-A1 COMPOUNDS AND ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-07-06 — — US disclosed
US-20230217811-A1 COMPOUNDS AND ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-07-06 — — US disclosed
US-11641775-B2 Compounds and organic electronic devices MERCK PATENT GMBH (DE) 2023-05-02 — — US disclosed
US-11641775-B2 Compounds and organic electronic devices MERCK PATENT GMBH (DE) 2023-05-02 — — US disclosed
US-11056652-B2 Compounds and organic electronic devices MERCK PATENT GMBH (DE) 2021-07-06 — — US disclosed
US-20210151682-A1 COMPOUNDS AND ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2021-05-20 — — US disclosed
US-10944058-B2 Compounds and organic electronic devices MERCK PATENT GMBH (DE) 2021-03-09 — — US disclosed
EP-3693437-A1 COMPOUNDS AND ORGANIC ELECTRONIC DEVICES Merck Patent GmbH (DE) 2020-08-12 — — EP disclosed
EP-3345984-B1 COMPOUNDS AND ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2020-03-04 — — EP disclosed
US-20190288209-A1 COMPOUNDS AND ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2019-09-19 — — US disclosed
US-20180097178-A1 COMPOUNDS AND ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2018-04-05 — — US disclosed
US-20180097178-A1 COMPOUNDS AND ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2018-04-05 — — US disclosed
EP-3077477-B1 COMPOUNDS AND ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2018-02-28 — — EP disclosed
US-9882142-B2 Compounds and organic electronic devices MERCK PATENT GMBH (DE) 2018-01-30 — — US disclosed
US-9882142-B2 Compounds and organic electronic devices MERCK PATENT GMBH (DE) 2018-01-30 — — US disclosed
US-20160301005-A1 COMPOUNDS AND ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2016-10-13 — — US disclosed
US-20160301005-A1 COMPOUNDS AND ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2016-10-13 — — US disclosed
US-20150179940-A1 COMPOUNDS AND ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2015-06-25 — — US disclosed
US-20150179940-A1 COMPOUNDS AND ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2015-06-25 — — US disclosed
WO-2015082056-A1 COMPOUNDS AND ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2015-06-11 — — 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 (9 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-10944058-B2 Compounds and organic electronic devices ETV6, CYP2C19, AFF2 NPC1 1165/4885RAB9A 1003/4885SMN1; SMN2 3110/4885
US-11056652-B2 Compounds and organic electronic devices ETV6, AFF2, CYP2C19 NPC1 1240/4885RAB9A 932/4885SMN1; SMN2 3031/4885
US-20230217811-A1 COMPOUNDS AND ORGANIC ELECTRONIC DEVICES ETV6, CYP2C19, AFF2 NPC1 1165/4885RAB9A 1003/4885SMN1; SMN2 3110/4885
US-20210151682-A1 COMPOUNDS AND ORGANIC ELECTRONIC DEVICES ETV6, CYP2C19, AFF2 NPC1 1165/4885RAB9A 1003/4885SMN1; SMN2 3110/4885
US-11641775-B2 Compounds and organic electronic devices ETV6, CYP2C19, AFF2 NPC1 1165/4885RAB9A 1003/4885SMN1; SMN2 3110/4885
US-20190288209-A1 COMPOUNDS AND ORGANIC ELECTRONIC DEVICES ETV6, AFF2, CYP2C19 NPC1 1240/4885RAB9A 932/4885SMN1; SMN2 3031/4885
US-20180097178-A1 COMPOUNDS AND ORGANIC ELECTRONIC DEVICES ETV6, CYP2C19, AFF2 NPC1 1165/4885RAB9A 1003/4885SMN1; SMN2 3110/4885
US-20150179940-A1 COMPOUNDS AND ORGANIC ELECTRONIC DEVICES ETV6, CYP2C19, AFF2 NPC1 1165/4885RAB9A 1003/4885SMN1; SMN2 3110/4885
US-20160301005-A1 COMPOUNDS AND ORGANIC ELECTRONIC DEVICES ETV6, AFF2, CYP2C19 NPC1 1240/4885RAB9A 932/4885SMN1; SMN2 3031/4885

“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.

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