SCHEMBL3309022

SCHEMBL3309022

CCCN(/C=N/c1cc(C)c(Oc2ccc(Br)c(Br)c2)cc1C)CC

nearest known ligand 0.30

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.30
MAPT P10636 1/20 0.30
RAB9A P51151 1/20 0.30
TSHR P16473 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL3309026 1.00 NPC1 (0.30) NPC1MAPTRAB9ATSHRSMN1; SMN2
SCHEMBL3313399 0.93 TSHR (0.32) TSHRSMN1; SMN2
SCHEMBL3313397 0.93 TSHR (0.32) TSHRSMN1; SMN2
SCHEMBL3308205 0.90 CYP1A2 (0.32)
SCHEMBL3310690 0.90 HTR2A (0.32)
SCHEMBL3303316 0.90
SCHEMBL3303313 0.90
SCHEMBL3308209 0.90 CYP1A2 (0.32)
SCHEMBL3308788 0.90 HTR2A (0.32)
SCHEMBL3307246 0.90 EGFR (0.31)

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-9199922-B2 Dihalophenoxyphenylamidines and use thereof as fungicides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-12-01 US claimed
EP-2136627-B1 DIHALOPHENOXYPHENYLAMIDINES AND USE THEREOF AS FUNGICIDES BAYER IP GMBH (DE) 2015-05-13 EP claimed
US-20100099558-A1 DIHALOPHENOXYPHENYLAMIDINES AND USE THEREOF AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2010-04-22 US claimed
US-9199922-B2 Dihalophenoxyphenylamidines and use thereof as fungicides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-12-01 US disclosed
US-20100099558-A1 DIHALOPHENOXYPHENYLAMIDINES AND USE THEREOF AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2010-04-22 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-20100099558-A1 DIHALOPHENOXYPHENYLAMIDINES AND USE THEREOF AS FUNGICIDES DDT, PAH, DNPH1 NPC1 4082/4885MAPT 2419/4885RAB9A 2950/4885

“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.