SCHEMBL20253184

SCHEMBL20253184

Cc1cc2c(cc1Cl)ncn2C(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.48
TP53 P04637 2/20 0.48
THRB P10828 1/20 0.48
NPC1 O15118 7/20 0.42
RAB9A P51151 7/20 0.42
SMN1; SMN2 Q16637 5/20 0.42
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
HPGD P15428 2/20 0.39
KCNH2 Q12809 1/20 0.39
GAA P10253 3/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
HIF1A Q16665 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL22883424 0.87 MAPT (0.48) MAPTTP53THRBNPC1RAB9A
SCHEMBL4352613 0.86 KCNH2 (0.39) MAPTTP53THRBSMN1; SMN2KDM4E
SCHEMBL16154685 0.85 POLB (0.47) MAPTTP53THRBNPC1RAB9A
SCHEMBL15907151 0.73 NPC1 (0.41) MAPTTP53THRBNPC1RAB9A
SCHEMBL19911318 0.71 NPC1 (0.61) MAPTTP53THRBNPC1RAB9A
SCHEMBL18136606 0.71 NPC1 (0.50) MAPTTP53THRBNPC1RAB9A
SCHEMBL5840794 0.70 ALDH1A1 (0.43) MAPTTP53RAB9ASMN1; SMN2KDM4E
SCHEMBL23786479 0.67 MAPT (0.38) MAPTTP53THRBNPC1RAB9A
SCHEMBL12770787 0.67 KCNH2 (0.83) NPC1RAB9ASMN1; SMN2ALDH1A1KMT2A
SCHEMBL16429379 0.67 NPC1 (0.62) MAPTTP53THRBNPC1RAB9A

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-20230287034-A1 CYCLIC DINUCLEOTIDES AS STING AGONISTS JANSSEN BIOTECH INC (US) 2023-09-14 US disclosed
US-20180162812-A1 COVALENT INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2018-06-14 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-20230287034-A1 CYCLIC DINUCLEOTIDES AS STING AGONISTS STING1, CGAS, IFNAR1 MAPT 4604/4885TP53 1210/4885THRB 1330/4885
US-20180162812-A1 COVALENT INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS MAPT 4316/4885TP53 7/4885THRB 2513/4885

“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.