SCHEMBL1944633

SCHEMBL1944633

Cc1ccccc1CNc1nn2cc(-c3ccc(F)c(Cl)c3)nc2s1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.46
F2RL3 Q96RI0 5/20 0.43
FYN P06241 2/20 0.43
SMN1; SMN2 Q16637 5/20 0.42
TP53 P04637 5/20 0.42
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
NFKB1 P19838 2/20 0.42
NFKB2 Q00653 2/20 0.42
RELA Q04206 2/20 0.42
KDM4E B2RXH2 1/20 0.41
HSD17B10 Q99714 1/20 0.41
ALOX15 P16050 1/20 0.40
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
TGFBR1 P36897 1/20 0.39
NR1H4 Q96RI1 1/20 0.39
TRPA1 O75762 1/20 0.39
ABL1 P00519 1/20 0.39

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
SCHEMBL1946050 0.88 F2RL3 (0.54) MAPTF2RL3FYNSMN1; SMN2TP53
SCHEMBL1943815 0.86 F2RL3 (0.54) MAPTF2RL3FYNSMN1; SMN2TP53
SCHEMBL1944803 0.86 NR1H4 (0.48) MAPTF2RL3FYNSMN1; SMN2TP53
SCHEMBL1945474 0.85 FYN (0.46) MAPTF2RL3FYNSMN1; SMN2TP53
SCHEMBL1945228 0.83 F2RL3 (0.54) MAPTF2RL3FYNSMN1; SMN2TP53
SCHEMBL1947064 0.82 F2RL3 (0.57) MAPTF2RL3FYNSMN1; SMN2TP53
SCHEMBL1946313 0.81 FYN (0.52) MAPTF2RL3FYNSMN1; SMN2TP53
SCHEMBL1945114 0.81 FYN (0.44) MAPTF2RL3FYNSMN1; SMN2TP53
SCHEMBL2255161 0.81 F2RL3 (0.42) MAPTF2RL3FYNSMN1; SMN2TP53
SCHEMBL1946937 0.81 MAPT (0.46) MAPTF2RL3FYNSMN1; SMN2TP53

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
EP-2307425-B1 IMIDAZOTHIADIAZOLES DERIVATIVES MERCK PATENT GMBH (DE) 2014-03-26 EP claimed
EP-2307425-B1 IMIDAZOTHIADIAZOLES DERIVATIVES MERCK PATENT GMBH (DE) 2014-03-26 EP disclosed
US-8389554-B2 Imidazothiadiazole derivatives MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 2013-03-05 US disclosed
US-20110130396-A1 IMIDAZOTHIADIAZOLE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2011-06-02 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-20110130396-A1 IMIDAZOTHIADIAZOLE DERIVATIVES TGFBR1, TGFBR2, IGF1R MAPT 4021/4885F2RL3 1121/4885FYN 1977/4885

“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.