SCHEMBL12848915

SCHEMBL12848915

O=C(Nc1c(F)cccc1F)c1nc2c(s1)-c1cc(-n3cnnc3)ccc1CCC2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.36
DHODH Q02127 2/20 0.34
CRACR2A Q9BSW2 1/20 0.34
SMN1; SMN2 Q16637 6/20 0.33
ALDH1A1 P00352 5/20 0.33
TP53 P04637 4/20 0.33
NPC1 O15118 4/20 0.33
RAB9A P51151 4/20 0.33
POLB P06746 3/20 0.33
MEN1 O00255 2/20 0.33
LMNA P02545 2/20 0.33
KMT2A Q03164 2/20 0.33
STIM1 Q13586 1/20 0.33
ORAI1 Q96D31 1/20 0.33
NFKB1 P19838 1/20 0.32
HTT P42858 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
DUSP3 P51452 2/20 0.32
ADORA2A P29274 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
SCHEMBL12848563 0.90 ADH5 (0.36) MAPT
SCHEMBL12848460 0.88 GPR142 (0.37) MAPTALDH1A1STIM1ORAI1KDM4E
SCHEMBL12848568 0.88 MAPT (0.34) MAPTDHODHCRACR2ASMN1; SMN2ALDH1A1
SCHEMBL12848966 0.87 MAPT (0.33) MAPTDHODHCRACR2AALDH1A1STIM1
SCHEMBL12848567 0.87 MAP3K5 (0.39)
SCHEMBL12848749 0.86 MAPT (0.34) MAPTDHODHCRACR2AALDH1A1TP53
SCHEMBL12848856 0.86 MAPT (0.33) MAPTDHODHCRACR2AALDH1A1STIM1
SCHEMBL12848566 0.86 MAP3K5 (0.35) MAPTDHODHCRACR2AALDH1A1STIM1
SCHEMBL14172542 0.86 MAOB (0.39) MAPTDHODHSMN1; SMN2ALDH1A1TP53
SCHEMBL12848751 0.85 HTR2A (0.35) MAPTDHODHSMN1; SMN2ALDH1A1LMNA

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-20110052643-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2011-03-03 US disclosed
WO-2009089305-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2009-07-16 WO 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-20110052643-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES TSLP, NFATC1, IL5 MAPT 1865/4885DHODH 1141/4885CRACR2A 3366/4885

“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.