SCHEMBL29929291

SCHEMBL29929291

Cc1cn(-c2nc(Cl)ncc2F)c2ccc([N+](=O)[O-])cc12

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.41
▸ RPS6KA5 O75582 1/20 0.39
▸ KMT2A Q03164 6/20 0.37
▸ OPRK1 P41145 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ POLB P06746 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ MEN1 O00255 4/20 0.35
▸ PIN1 Q13526 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ S1PR4 O95977 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ F2R P25116 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ F2RL3 Q96RI0 1/20 0.34

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
SCHEMBL26977540 1.00 MAPT (0.41) MAPTRPS6KA5KMT2AOPRK1ALDH1A1
SCHEMBL23611886 0.90 MAPT (0.43) MAPTRPS6KA5KMT2AOPRK1ALDH1A1
SCHEMBL30053407 0.90 MAPT (0.43) MAPTRPS6KA5KMT2AOPRK1ALDH1A1
SCHEMBL23611969 0.89 MAPT (0.42) MAPTRPS6KA5KMT2AOPRK1ALDH1A1
SCHEMBL29929645 0.89 MAPT (0.42) MAPTRPS6KA5KMT2AOPRK1ALDH1A1
SCHEMBL29929049 0.84 VCAM1 (0.41) MAPTKMT2AOPRK1ALDH1A1L3MBTL1
SCHEMBL26977398 0.84 VCAM1 (0.41) MAPTKMT2AOPRK1ALDH1A1L3MBTL1
SCHEMBL29929752 0.80 CCNT1 (0.41) MAPTALDH1A1
SCHEMBL26980190 0.80 CCNT1 (0.41) MAPTALDH1A1
SCHEMBL30671846 0.79 CDC7 (0.44) MAPTRPS6KA5KMT2AOPRK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4297873-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF THEIR USE Tyra Biosciences, Inc. (US) 2024-01-03 — — EP disclosed
CN-117136184-A Aminopyrimidine compounds and methods of use thereof 泰拉生物科学公司 2023-11-28 — — CN disclosed
WO-2022182972-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF THEIR USE TYRA BIOSCIENCES, INC. (US) 2022-09-01 — — WO disclosed
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