SCHEMBL18094073

SCHEMBL18094073

COC(=O)c1cc(Br)cc(F)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.41
SLC6A3 Q01959 3/20 0.41
ABL1 P00519 1/20 0.40
SOS1 Q07889 1/20 0.40
PDK2 Q15119 2/20 0.39
NR4A2 P43354 1/20 0.39
GAA P10253 3/20 0.38
ALDH1A1 P00352 2/20 0.38
SLC6A4 P31645 2/20 0.38
KMT2A Q03164 3/20 0.38
HTT P42858 1/20 0.38
NPC1 O15118 1/20 0.38
LMNA P02545 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HPGD P15428 1/20 0.37
PDK1 Q15118 1/20 0.37
PDK3 Q15120 1/20 0.37
PDK4 Q16654 1/20 0.37

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
SCHEMBL25751456 0.82 SOS1 (0.45) NOTUMSLC6A3SOS1PDK2NR4A2
SCHEMBL30498167 0.82 SOS1 (0.45) NOTUMSLC6A3SOS1PDK2NR4A2
SCHEMBL1228180 0.82 HSD17B10 (0.47) NOTUMSLC6A3ABL1SOS1PDK2
SCHEMBL20076067 0.81 NOTUM (0.42) NOTUMSLC6A3SOS1PDK2NR4A2
SCHEMBL1516592 0.81 GAA (0.44) NOTUMSLC6A3SOS1PDK2NR4A2
SCHEMBL21198962 0.81 NOTUM (0.42) NOTUMSLC6A3SOS1PDK2NR4A2
SCHEMBL29570702 0.81 NOTUM (0.42) NOTUMSLC6A3SOS1PDK2NR4A2
SCHEMBL16088526 0.81 CA12 (0.44) NOTUMSLC6A3ABL1PDK2NR4A2
SCHEMBL23526170 0.79 SOS1 (0.54) NOTUMSLC6A3SOS1PDK2NR4A2
SCHEMBL22492252 0.79 SOS1 (0.43) NOTUMSLC6A3ABL1SOS1NR4A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10836732-B2 Compounds for combating arthropods BAYER ANIMAL HEALTH GMBH (DE) 2020-11-17 US disclosed
US-10150737-B2 Compounds for controlling arthropods BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-12-11 US disclosed
US-9758485-B2 Compounds for controlling arthropods BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-09-12 US disclosed
WO-2016174052-A1 ANTIPARASITIC COMBINATIONS BAYER ANIMAL HEALTH GMBH (DE) 2016-11-03 WO disclosed
US-20160297765-A1 NOVEL COMPOUNDS FOR CONTROLLING ARTHROPODS ELANCO ANIMAL HEALTH GMBH (DE) 2016-10-13 US disclosed
US-20160280668-A1 NOVEL COMPOUNDS FOR COMBATING ARTHROPODS ELANCO ANIMAL HEALTH GMBH (DE) 2016-09-29 US disclosed
US-20160278379-A1 NOVEL COMPOUNDS FOR CONTROLLING ARTHROPODS ELANCO ANIMAL HEALTH GMBH (DE) 2016-09-29 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 (5 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-10836732-B2 Compounds for combating arthropods PRDX4, SERPINB6, GSTA1 NOTUM 2064/4885SLC6A3 3248/4885ABL1 2785/4885
US-20160278379-A1 NOVEL COMPOUNDS FOR CONTROLLING ARTHROPODS CYP4X1, CYP4B1, SERPINB6 NOTUM 1558/4885SLC6A3 4216/4885ABL1 3006/4885
US-10150737-B2 Compounds for controlling arthropods SERPINB6, CYP4X1, C1S NOTUM 1907/4885SLC6A3 3886/4885ABL1 2355/4885
US-20160280668-A1 NOVEL COMPOUNDS FOR COMBATING ARTHROPODS PRDX4, CYP4X1, PRDX1 NOTUM 1936/4885SLC6A3 3949/4885ABL1 3117/4885
US-20160297765-A1 NOVEL COMPOUNDS FOR CONTROLLING ARTHROPODS CYP4X1, CYP4B1, SERPINB6 NOTUM 1558/4885SLC6A3 4216/4885ABL1 3006/4885

“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.