SCHEMBL4869156

SCHEMBL4869156

Fc1c(F)c(F)c2c(ccn2-c2ccc(-c3nc(-c4ccccn4)cn3-c3cccnc3)cc2)c1F

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.36
CYP2A6 P11509 2/20 0.36
PTGS1 P23219 1/20 0.36
CYP2E1 P05181 1/20 0.34
CYP3A4 P08684 1/20 0.34
PTGS2 P35354 7/20 0.34
MDM2 Q00987 1/20 0.33
FLT3 P36888 1/20 0.33
GRM5 P41594 3/20 0.32
NPC1 O15118 1/20 0.32
TP53 P04637 1/20 0.32
PKM P14618 1/20 0.32
TSHR P16473 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL4810083 0.84 MAPT (0.39) MAPTCYP2A6PTGS1CYP2E1CYP3A4
SCHEMBL4875437 0.80 MAPT (0.47) MAPTCYP2A6PTGS1CYP2E1CYP3A4
SCHEMBL4859211 0.80 MAPT (0.42) MAPTCYP2A6PTGS1CYP2E1CYP3A4
SCHEMBL4875319 0.79 MAPT (0.38) MAPTCYP2A6PTGS1CYP2E1CYP3A4
SCHEMBL4808663 0.78 CYP2A6 (0.54) MAPTCYP2A6CYP2E1CYP3A4PTGS2
SCHEMBL4875388 0.77 GRIA1 (0.39) MAPTPTGS2GRM5
SCHEMBL4810066 0.77 CYP2A6 (0.45) MAPTCYP2A6PTGS1CYP2E1CYP3A4
SCHEMBL4809561 0.76 CYP3A4 (0.52) CYP2A6CYP3A4NPC1TSHRRAB9A
SCHEMBL4812854 0.74 MAPT (0.58) MAPTCYP3A4RAB9ASMN1; SMN2
SCHEMBL4877197 0.74 MAPT (0.45) MAPTCYP2A6PTGS1CYP2E1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080090834-A1 SELECTIVE AZOLE PDE10A INHIBITOR COMPOUNDS PFIZER INC 2008-04-17 US claimed
US-20080090834-A1 SELECTIVE AZOLE PDE10A INHIBITOR COMPOUNDS PFIZER INC 2008-04-17 US disclosed
US-20080090834-A1 SELECTIVE AZOLE PDE10A INHIBITOR COMPOUNDS PFIZER INC 2008-04-17 US disclosed
US-20080090834-A1 SELECTIVE AZOLE PDE10A INHIBITOR COMPOUNDS PFIZER INC 2008-04-17 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-20080090834-A1 SELECTIVE AZOLE PDE10A INHIBITOR COMPOUNDS PDE5A, PDE3B, PDE12 MAPT 964/4885CYP2A6 157/4885PTGS1 527/4885

“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.