SCHEMBL30856168

SCHEMBL30856168

Cc1c([N+](=O)[O-])cc2[nH]nc(F)c2c1Br

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 3/20 0.47
▸ MAPT P10636 4/20 0.33
▸ GRIN2D O15399 3/20 0.33
▸ GRIN3B O60391 3/20 0.33
▸ GRIN1 Q05586 3/20 0.33
▸ GRIN2A Q12879 3/20 0.33
▸ GRIN2B Q13224 3/20 0.33
▸ GRIN2C Q14957 3/20 0.33
▸ GRIN3A Q8TCU5 3/20 0.33
▸ CYP3A4 P08684 2/20 0.33
▸ TSHR P16473 2/20 0.33
▸ BLM P54132 2/20 0.33
▸ PIM1 P11309 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ GRIK1 P39086 1/20 0.33
▸ GRIA1 P42261 1/20 0.33
▸ GRIA2 P42262 1/20 0.33
▸ GRIA3 P42263 1/20 0.33
▸ GRIA4 P48058 1/20 0.33

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
SCHEMBL1250100 0.78 AKR1B1 (0.38) CYP1A2MAPTGRIN2DGRIN3BGRIN1
SCHEMBL470187 0.72 ALDH1A1 (0.34) CYP1A2MAPTGRIN2DGRIN3BGRIN1
SCHEMBL30811696 0.72 CYP3A4 (0.40) MAPTCYP3A4LMNAHPGDGRIA1
SCHEMBL30856077 0.72 CYP1A2 (0.51) CYP1A2MAPTCYP3A4TSHRBLM
SCHEMBL27096286 0.70 CYP1A2 (0.67) CYP1A2MAPTGRIN2DGRIN3BGRIN1
SCHEMBL29478827 0.70 CYP1A2 (0.67) CYP1A2MAPTGRIN2DGRIN3BGRIN1
SCHEMBL22655651 0.69 MAPT (0.39) CYP1A2MAPTGRIN2DGRIN3BGRIN1
SCHEMBL2215478 0.69 TDO2 (0.46) PIM1PIM3NOS1
SCHEMBL27264780 0.68 CYP1A2 (0.59) CYP1A2MAPTCYP3A4TSHRLMNA
SCHEMBL30217347 0.68 CYP1A2 (0.59) CYP1A2MAPTCYP3A4TSHRLMNA

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
CN-120152713-A Tricyclic aryl derivatives and compositions and methods thereof 昂胜医疗科技公司 2025-06-13 — — CN disclosed
EP-4561562-A2 TRICYCLIC ARYL DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF Ensem Therapeutics, Inc. (US) 2025-06-04 — — EP disclosed
WO-2024026128-A2 TRICYCLIC ARYL DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF ENSEM THERAPEUTICS, INC. (US) 2024-02-01 — — WO disclosed
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