SCHEMBL10275628

SCHEMBL10275628

CCO/C=C\C(=O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 2/20 0.54
MAPT P10636 7/20 0.54
RAB9A P51151 7/20 0.54
NPC1 O15118 5/20 0.54
KMT2A Q03164 3/20 0.54
MAOB P27338 2/20 0.50
RECQL P46063 2/20 0.50
MAOA P21397 1/20 0.50
PKM P14618 1/20 0.50
MAPK1 P28482 2/20 0.49
MEN1 O00255 2/20 0.49
BCHE P06276 3/20 0.48
LMNA P02545 2/20 0.48
PLIN1 O60240 1/20 0.48
TNFRSF1A P19438 1/20 0.48
ACHE P22303 1/20 0.48
PLIN5 Q00G26 1/20 0.48
CYP1B1 Q16678 1/20 0.48
ABHD5 Q8WTS1 1/20 0.48
CASP3 P42574 1/20 0.48

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
SCHEMBL10275631 1.00 AKT1 (0.54) AKT1MAPTRAB9ANPC1KMT2A
SCHEMBL10439177 1.00 AKT1 (0.54) AKT1MAPTRAB9ANPC1KMT2A
SCHEMBL27550293 0.86 LMNA (0.51) AKT1MAPTRAB9ANPC1KMT2A
SCHEMBL27948287 0.82 HTT (0.53) MAPTKMT2AMEN1LMNACYP1B1
SCHEMBL5852785 0.81 MAPT (0.51) AKT1MAPTRAB9ANPC1KMT2A
SCHEMBL7399749 0.80 CYP1A1 (0.54) MAPTKMT2AMAPK1MEN1LMNA
SCHEMBL7399751 0.80 CYP1A1 (0.54) MAPTKMT2AMAPK1MEN1LMNA
SCHEMBL27488705 0.80 GPR52 (0.53) AKT1MAPTRAB9ANPC1KMT2A
SCHEMBL10349157 0.80 MAPT (0.55) AKT1MAPTRAB9ANPC1KMT2A
SCHEMBL2901223 0.80 LMNA (0.45) AKT1MAPTRAB9ANPC1KMT2A

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-20120178915-A1 PYRIMIDINE DERIVATIVES AND ANALOGS, PREPARATION METHOD AND USE THEREOF XU LIFENG (US) 2012-07-12 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-20120178915-A1 PYRIMIDINE DERIVATIVES AND ANALOGS, PREPARATION METHOD AND USE THEREOF TYMP, TYMS, ADORA3 AKT1 1752/4885MAPT 750/4885RAB9A 3784/4885

“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.