SCHEMBL14190823

SCHEMBL14190823

CCc1c(C)nn(C(C)(C)C)c1C

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ P2RX7 Q99572 1/20 0.36
▸ TSHR P16473 2/20 0.34
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 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
SCHEMBL22434959 0.85 TSHR (0.36) HPGDSMN1; SMN2P2RX7TSHRMEN1
SCHEMBL23400973 0.79 TSHR (0.35) HPGDSMN1; SMN2P2RX7TSHRMEN1
SCHEMBL4171724 0.79 HPGD (0.46) HPGDSMN1; SMN2TSHRMEN1KMT2A
SCHEMBL23399191 0.79 P2RX7 (0.30) P2RX7TSHR
SCHEMBL22412654 0.76 P2RX7 (0.39) HPGDSMN1; SMN2P2RX7TSHRMEN1
SCHEMBL18878191 0.76 TSHR (0.32) HPGDSMN1; SMN2P2RX7TSHRMEN1
SCHEMBL18884355 0.75 HPGD (0.33) HPGDSMN1; SMN2P2RX7TSHRMEN1
SCHEMBL21166086 0.73 HPGD (0.35) HPGDSMN1; SMN2P2RX7
SCHEMBL13148355 0.72 HPGD (0.37) HPGDSMN1; SMN2TSHR
SCHEMBL15716050 0.70 HPGD (0.36) HPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9751897-B1 Derivatives of Bodipy OREGON HEALTH & SCIENCE UNIVERSITY (US) 2017-09-05 — — US disclosed
WO-2008075172-A2 NICOTINAMIDE DERIVATIVES AS INHIBITORS OF H-PGDS AND THEIR USE FOR TREATING PROSTAGLANDIN D2 MEDIATED DISEASES PFIZER PRODUCTS INC. (US) 2008-06-26 — — WO disclosed
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