SCHEMBL4556199

SCHEMBL4556199

CCc1cnc2cc(C(C)(C)C)ccc2c1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.37
PARP1 P09874 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
PDE10A Q9Y233 4/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2A6 P11509 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SCN10A Q9Y5Y9 2/20 0.34
TP53 P04637 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
PDE4D Q08499 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
SCHEMBL10280264 0.81 MAOB (0.40) MAOBTRPV1CYP1A2CYP2A6NPC1
SCHEMBL803417 0.80 CYP1A2 (0.50) MAOBPARP1PDE10ACYP1A2CYP2A6
SCHEMBL1695518 0.80 TRPV1 (0.40) MAOBTRPV1PDE10ACYP1A2NPC1
SCHEMBL24272452 0.78 MAOB (0.38) MAOBPARP1TRPV1PDE10A
SCHEMBL14439551 0.78 TERT (0.41) CYP1A2CYP2A6NPC1RAB9ASCN10A
SCHEMBL21622433 0.77 PDE10A (0.50) MAOBPARP1PDE10ACYP1A2CYP2A6
SCHEMBL14378414 0.77 CYP1A2 (0.53) TRPV1PDE10ACYP1A2NPC1RAB9A
SCHEMBL6172988 0.76 CYP1A2 (0.46) MAOBPARP1PDE10ACYP1A2CYP2A6
SCHEMBL21575906 0.76 TRPV1 (0.38) TRPV1PDE10ACYP1A2NPC1RAB9A
SCHEMBL29471062 0.76 CYP1A2 (0.46) MAOBPARP1PDE10ACYP1A2CYP2A6

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-20230141569-A1 FLUORESCENT DYE, AND PREPARATION METHOD AND USES THEREOF FLUORESCENCE DIAGNOSIS (SHANGHAI) BIOTECH COMPANY LTD. (CN) 2023-05-11 US disclosed
US-8178557-B2 Compounds and methods of use AMGEN INC. (US) 2012-05-15 US disclosed
US-20090176774-A1 Compounds and methods of use AMGEN INC. (US) 2009-07-09 US disclosed
US-7435823-B2 Compounds and methods of use AMGEN INC. (US) 2008-10-14 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 (2 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-20230141569-A1 FLUORESCENT DYE, AND PREPARATION METHOD AND USES THEREOF DNASE1, DNA2, RNGTT MAOB 1473/4885PARP1 279/4885TRPV1 4511/4885
US-20090176774-A1 Compounds and methods of use HGF, HGFAC, MET MAOB 902/4885PARP1 1824/4885TRPV1 3658/4885

“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.