SCHEMBL17409847

SCHEMBL17409847

CSc1c(Cl)ccc(C(=O)Nc2nonc2C)c1C

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 9/20 0.46
RAB9A P51151 9/20 0.46
POLB P06746 1/20 0.46
KMT2A Q03164 4/20 0.44
MEN1 O00255 2/20 0.44
TSHR P16473 1/20 0.44
RXFP1 Q9HBX9 2/20 0.41
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.38
SENP2 Q9HC62 1/20 0.36
MAPT P10636 2/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
GFER P55789 1/20 0.35

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
SCHEMBL17409846 0.87 NPC1 (0.46) NPC1RAB9APOLBKMT2AMEN1
SCHEMBL17409841 0.82 NPC1 (0.42) NPC1RAB9APOLBKMT2AMEN1
SCHEMBL18932460 0.77 NPC1 (0.51) NPC1RAB9APOLBKMT2AMEN1
SCHEMBL1457591 0.76 NPC1 (0.63) NPC1RAB9APOLBKMT2AMEN1
SCHEMBL15223589 0.75 KMT2A (0.44) NPC1RAB9APOLBKMT2AMEN1
SCHEMBL17413597 0.75 KDM4E (0.43) NPC1RAB9AKMT2AMEN1TSHR
SCHEMBL22245544 0.72 NPC1 (0.46) NPC1RAB9APOLBKMT2AMEN1
SCHEMBL10506224 0.72 KMT2A (0.63) NPC1RAB9APOLBKMT2AMEN1
SCHEMBL25607507 0.72 NPC1 (0.46) NPC1RAB9APOLBKMT2AMEN1
SCHEMBL17409852 0.71 NPC1 (0.45) NPC1RAB9APOLBKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3160946-B1 HERBICIDAL BENZOIC ACID AMIDES BAYER CROPSCIENCE AG (DE) 2018-06-06 EP disclosed
US-9988359-B2 Herbicidally active benzoic acid amides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-06-05 US disclosed
US-9988359-B2 Herbicidally active benzoic acid amides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-06-05 US disclosed
US-20170197926-A1 HERBICIDALLY ACTIVE BENXZOIC ACID AMIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-07-13 US disclosed
US-20170197926-A1 HERBICIDALLY ACTIVE BENXZOIC ACID AMIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-07-13 US disclosed
WO-2016001074-A1 HERBICIDALLY ACTIVE BENZOIC ACID AMIDES BAYER CROPSCIENCE AG (DE) 2016-01-07 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-20170197926-A1 HERBICIDALLY ACTIVE BENXZOIC ACID AMIDES AOX1, GABRA5, GABRD NPC1 4588/4885RAB9A 3263/4885POLB 2588/4885

“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.