SCHEMBL1107910

SCHEMBL1107910

CC1(C)c2cc(-c3nnc(-c4cccc(-c5ccccc5C(F)(F)F)n4)s3)ccc2-c2ccc(-c3nnc(-c4cccc(-c5ccccc5C(F)(F)F)n4)s3)cc21

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 2/20 0.37
PIM3 Q86V86 2/20 0.37
PIM2 Q9P1W9 2/20 0.37
HSD11B1 P28845 3/20 0.37
EIF4E P06730 1/20 0.37
PDK2 Q15119 6/20 0.36
TRPA1 O75762 1/20 0.35
ACP1 P24666 1/20 0.35
F2RL3 Q96RI0 1/20 0.35
SCN9A Q15858 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
GUSB P08236 1/20 0.34
KMO O15229 1/20 0.34

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
SCHEMBL1107921 0.86 SCN9A (0.45) PIM1PIM3PIM2HSD11B1ACP1
SCHEMBL1107868 0.86 KMO (0.41) PIM1PIM3PIM2HSD11B1TRPA1
SCHEMBL1107893 0.85 HSD11B1 (0.46) PIM1PIM3PIM2HSD11B1EIF4E
SCHEMBL1107958 0.84 SCN9A (0.43) PIM1PIM3PIM2HSD11B1TRPA1
SCHEMBL1107924 0.84 PIM1 (0.36) PIM1PIM3PIM2EIF4ESCN9A
SCHEMBL1107936 0.83 GUSB (0.41) PIM1PIM3PIM2PDK2GUSB
SCHEMBL1107908 0.83 KMO (0.44) HSD11B1ACP1F2RL3SCN9ACYP1A2
SCHEMBL1107912 0.83 PTPN11 (0.41) PIM1PIM3PIM2GUSB
SCHEMBL1107928 0.82 PIM1 (0.45) PIM1PIM3PIM2EIF4EF2RL3
SCHEMBL1107869 0.82 PIM1 (0.46) PIM1PIM3PIM2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8153277-B2 Compound having thiadiazole ring structure substituted with pyridyl group and organic electroluminescent device HODOGAYA CHEMICAL CO., LTD. (JP) 2012-04-10 US disclosed
US-8153277-B2 Compound having thiadiazole ring structure substituted with pyridyl group and organic electroluminescent device HODOGAYA CHEMICAL CO., LTD. (JP) 2012-04-10 US disclosed
US-20090108750-A1 COMPOUND HAVING THIADIAZOLE RING STRUCTURE SUBSTITUTED WITH PYRIDYL GROUP AND ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO., LTD. (JP) 2009-04-30 US disclosed
US-20090108750-A1 COMPOUND HAVING THIADIAZOLE RING STRUCTURE SUBSTITUTED WITH PYRIDYL GROUP AND ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO., LTD. (JP) 2009-04-30 US disclosed
EP-2009013-A1 COMPOUND HAVING THIADIAZOLE RING STRUCTURE SUBSTITUTED WITH PYRIDYL GROUP AND ORGANIC ELECTROLUMINESCENT DEVICE Hodogaya Chemical Co., Ltd. (JP) 2008-12-31 EP 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-20090108750-A1 COMPOUND HAVING THIADIAZOLE RING STRUCTURE SUBSTITUTED WITH PYRIDYL GROUP AND ORGANIC ELECTROLUMINESCENT DEVICE OXA1L, SLCO4C1, SLCO2B1 PIM1 1477/4885PIM3 1919/4885PIM2 1487/4885

“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.