SCHEMBL3614213

SCHEMBL3614213

BrCc1cn(-c2ccccc2)nn1

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.68
L3MBTL1 Q9Y468 2/20 0.68
MAOA P21397 1/20 0.68
DRD2 P14416 3/20 0.57
DRD4 P21917 3/20 0.57
DRD3 P35462 3/20 0.57
CD74 P04233 1/20 0.53
MIF P14174 1/20 0.53
NPC1 O15118 2/20 0.50
HDAC8 Q9BY41 1/20 0.50
KDM1A O60341 1/20 0.50
P2RX7 Q99572 1/20 0.50
RAB9A P51151 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
GLA P06280 1/20 0.48
TYMS P04818 1/20 0.48

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
SCHEMBL27711741 0.85 NOTUM (0.64) NOTUML3MBTL1MAOADRD2DRD4
SCHEMBL3760196 0.81 NOTUM (0.50) NOTUML3MBTL1MAOACD74MIF
SCHEMBL28173683 0.81 RXRA (0.54) NOTUML3MBTL1MAOAMIF
SCHEMBL28064712 0.81 NOTUM (0.68) NOTUML3MBTL1MAOADRD2DRD4
SCHEMBL2821461 0.81 NOTUM (1.00) NOTUML3MBTL1MAOAP2RX7
SCHEMBL3777938 0.81 NOTUM (0.68) NOTUML3MBTL1MAOADRD2DRD4
SCHEMBL16401577 0.81 NOTUM (1.00) NOTUML3MBTL1MAOADRD2DRD4
SCHEMBL4434629 0.81 NOTUM (0.68) NOTUML3MBTL1MAOADRD2DRD4
Bromide SCHEMBL1882333 0.79 NOTUM (0.66) NOTUML3MBTL1MAOADRD2DRD4
SCHEMBL28185435 0.79 NOTUM (0.56) NOTUML3MBTL1MAOACD74MIF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12565492-B2 Anaplastic Lymphoma Kinase (ALK) degraders and uses thereof TRIANA BIOMEDICINES, INC. (US) 2026-03-03 US disclosed
US-20260042752-A1 ANAPLASTIC LYMPHOMA KINASE (ALK) DEGRADERS AND USES THEREOF TRIANA BIOMEDICINES INC (US) 2026-02-12 US disclosed
CN-110483483-A A kind of multiple tooth nitrogen ligand compound of chirality and its preparation method and application UNIV EAST CHINA NORMAL 2019-11-22 CN disclosed
US-7807684-B2 HIV reverse transcriptase inhibitors MERCK SHARP & DOHME CORP. (US) 2010-10-05 US disclosed
US-7807684-B2 HIV reverse transcriptase inhibitors MERCK SHARP & DOHME CORP. (US) 2010-10-05 US disclosed
US-7807684-B2 HIV reverse transcriptase inhibitors MERCK SHARP & DOHME CORP. (US) 2010-10-05 US disclosed
EP-1912935-A2 HIV REVERSE TRANSCRIPTASE INHIBITORS Merck & Co., Inc. (US) 2008-04-23 EP disclosed
WO-2007015809-A2 HIV REVERSE TRANSCRIPTASE INHIBITORS MERCK & CO., INC. (US) 2007-02-08 WO disclosed
WO-2007015809-A2 HIV REVERSE TRANSCRIPTASE INHIBITORS MERCK & CO., INC. (US) 2007-02-08 WO disclosed
US-20070021442-A1 HIV reverse transcriptase inhibitors MERCK SHARP & DOHME CORP. 2007-01-25 US disclosed
US-20070021442-A1 HIV reverse transcriptase inhibitors MERCK SHARP & DOHME CORP. 2007-01-25 US disclosed
US-20070021442-A1 HIV reverse transcriptase inhibitors MERCK SHARP & DOHME CORP. 2007-01-25 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 (3 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-20260042752-A1 ANAPLASTIC LYMPHOMA KINASE (ALK) DEGRADERS AND USES THEREOF ALK, NTRK1, NTRK3 NOTUM 233/4885L3MBTL1 1227/4885MAOA 2111/4885
US-20070021442-A1 HIV reverse transcriptase inhibitors POLRMT, RNGTT, POLR2E NOTUM 1408/4885L3MBTL1 1034/4885MAOA 611/4885
US-12565492-B2 Anaplastic Lymphoma Kinase (ALK) degraders and uses thereof ALK, NTRK3, NTRK1 NOTUM 1345/4885L3MBTL1 2475/4885MAOA 1667/4885

“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.