SCHEMBL25150575

SCHEMBL25150575

CCc1c(-c2ccccc2F)nn2ccc(N3CCOCC3)nc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMPD3 Q9NY59 2/20 0.42
▸ PIK3CD O00329 5/20 0.42
▸ PIK3CG P48736 5/20 0.42
▸ PIK3C2B O00750 4/20 0.42
▸ MTOR P42345 4/20 0.42
▸ GRIA1 P42261 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ KMT2A Q03164 2/20 0.39
▸ POLB P06746 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ DGAT1 O75907 1/20 0.38
▸ SOAT1 P35610 1/20 0.38
▸ STK4 Q13043 1/20 0.38
▸ STK3 Q13188 1/20 0.38
▸ LRRK2 Q5S007 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ CNR2 P34972 1/20 0.38
▸ PRKDC P78527 1/20 0.38

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
SCHEMBL25150576 0.83 SMPD3 (0.42) SMPD3PIK3CDPIK3CGGRIA1NPC1
SCHEMBL29939586 0.81 DGAT1 (0.55) DGAT1SOAT1
SCHEMBL25150512 0.81 DGAT1 (0.55) DGAT1SOAT1
SCHEMBL23014103 0.80 SMPD3 (0.41) SMPD3PIK3CDGRIA1NPC1KMT2A
SCHEMBL29703828 0.80 SMPD3 (0.41) SMPD3PIK3CDGRIA1NPC1KMT2A
SCHEMBL25150620 0.73 MAOB (0.41) SMPD3NPC1ALDH1A1TP53
SCHEMBL29939181 0.71 DGAT1 (0.45) NPC1KMT2APOLBALDH1A1LMNA
SCHEMBL25150706 0.71 DGAT1 (0.45) NPC1KMT2APOLBALDH1A1LMNA
SCHEMBL23013953 0.70 MAOB (0.40) SMPD3NPC1
SCHEMBL29703795 0.70 MAOB (0.40) SMPD3NPC1

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
US-11634425-B2 Pharmaceutical compounds PFIZER INC. (US) 2023-04-25 — — 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 (1 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-11634425-B2 Pharmaceutical compounds GABRA6, CHRNA6, CNR1 SMPD3 4665/4885PIK3CD 4789/4885PIK3CG 4772/4885

“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.

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