SCHEMBL29024288

SCHEMBL29024288

c1ccc(C(Nc2cnc(C3CC3)cn2)c2ccccc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 9/20 0.41
▸ IGF1R P08069 1/20 0.40
▸ S1PR3 Q99500 1/20 0.40
▸ CFTR P13569 1/20 0.38
▸ GOPC Q9HD26 1/20 0.38
▸ HCRTR1 O43613 1/20 0.37
▸ HDAC3 O15379 1/20 0.36
▸ HDAC1 Q13547 1/20 0.36
▸ HDAC2 Q92769 1/20 0.36
▸ HDAC6 Q9UBN7 1/20 0.36
▸ KDM4C Q9H3R0 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ DEGS1 O15121 1/20 0.33
▸ CYP19A1 P11511 1/20 0.33
▸ MAPK1 P28482 1/20 0.32

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
SCHEMBL23768153 0.75 HCAR3 (0.38) IGF1RHCRTR1
SCHEMBL29024293 0.70 CFTR (0.39) ACHES1PR3CFTRGOPCHDAC3
SCHEMBL21016980 0.69 CSF1R (0.39) HCRTR1
SCHEMBL21831103 0.69 NOTUM (0.39) HCRTR1
SCHEMBL16775795 0.67 ALDH1A1 (0.43) HCRTR1LMNADEGS1
SCHEMBL16754403 0.67 ABL1 (0.42) HCRTR1DEGS1
SCHEMBL15408413 0.65 RAB9A (0.54) HCRTR1HDAC3HDAC1HDAC2HDAC6
SCHEMBL21017010 0.65 HCAR3 (0.38) IGF1RHCRTR1MAPK1
SCHEMBL21016983 0.65 HCRTR1 (0.33) HCRTR1
SCHEMBL22877206 0.65 HCAR3 (0.46) HCRTR1HDAC3HDAC1HDAC2HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115956070-A Sulfonamide compounds 阿纳克西斯制药股份有限公司 2023-04-11 — — CN disclosed
Send feedback