SCHEMBL3830652

SCHEMBL3830652

Cc1cc(Br)ccc1C1OCCO1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.39
HPGD P15428 1/20 0.39
MAPT P10636 3/20 0.35
POLB P06746 1/20 0.35
ALDH1A1 P00352 1/20 0.34
MAPK1 P28482 1/20 0.34
KDM1A O60341 4/20 0.33
NSD2 O96028 1/20 0.33
CASP6 P55212 1/20 0.33
KDM1B Q8NB78 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
LMNA P02545 1/20 0.32
BLM P54132 1/20 0.32
TSHR P16473 1/20 0.31
MEN1 O00255 1/20 0.31
ALOX15 P16050 1/20 0.31
ALOX12 P18054 1/20 0.31
HBB P68871 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL2276882 0.85 HTT (0.36) HTTHPGDMAPTPOLBNSD2
SCHEMBL5836354 0.80 ALDH1A1 (0.38) HPGDALDH1A1NSD2CASP6NPC1
SCHEMBL30623726 0.78 MAPT (0.40) HTTHPGDMAPTPOLBALDH1A1
SCHEMBL25386684 0.77 KDM1A (0.39) MAPTKDM1ANSD2CASP6KDM1B
SCHEMBL31562913 0.77 ALOX15 (0.39) HTTHPGDMAPTPOLBALDH1A1
SCHEMBL30409263 0.77 KDM1A (0.53) HTTMAPTALDH1A1KDM1AKDM1B
SCHEMBL25384149 0.77 ALOX15 (0.39) HTTHPGDMAPTPOLBALDH1A1
SCHEMBL509469 0.77 KDM1A (0.53) HTTMAPTALDH1A1KDM1AKDM1B
SCHEMBL1704526 0.77 NPC1 (0.39) HTTPOLBALDH1A1NPC1RAB9A
SCHEMBL12407936 0.74 HTR2C (0.40) POLBKDM1AKDM1BNPC1RAB9A

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-1828127-A4 INSECTICIDAL BIS(SUBSTITUTED PHENYL)-1-äÝ4-(SATURATED HETEROCYCLYL-SUBSTITUTED)PHENYLMETHYL¨-(4-PIPERIDYL)üMETHANE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2009-04-29 EP disclosed
US-20090082203-A1 INSECTICIDAL BIS(SUBSTITUTED PHENYL)-1-{[4-(SATURATED HETEROCYCLYL-SUBSTITUTED)PHENYLMETHYL]- (4-PIPERIDYL)}METHANE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2009-03-26 US disclosed
US-20090082203-A1 INSECTICIDAL BIS(SUBSTITUTED PHENYL)-1-{[4-(SATURATED HETEROCYCLYL-SUBSTITUTED)PHENYLMETHYL]- (4-PIPERIDYL)}METHANE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2009-03-26 US disclosed
US-20090082203-A1 INSECTICIDAL BIS(SUBSTITUTED PHENYL)-1-{[4-(SATURATED HETEROCYCLYL-SUBSTITUTED)PHENYLMETHYL]- (4-PIPERIDYL)}METHANE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2009-03-26 US disclosed
EP-1828127-A2 INSECTICIDAL BIS(SUBSTITUTED PHENYL)-1-äÝ4-(SATURATED HETEROCYCLYL-SUBSTITUTED)PHENYLMETHYL¨-(4-PIPERIDYL)üMETHANE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2007-09-05 EP disclosed
WO-2006065659-A2 INSECTICIDAL BIS(SUBSTITUTED PHENYL)-1-{[4-(SATURATED HETEROCYCLYL-SUBSTITUTED)PHENYLMETHYL]-(4-PIPERIDYL)}METHANE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2006-06-22 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-20090082203-A1 INSECTICIDAL BIS(SUBSTITUTED PHENYL)-1-{[4-(SATURATED HETEROCYCLYL-SUBSTITUTED)PHENYLMETHYL]- (4-PIPERIDYL)}METHANE DERIVATIVES DDT, API5, MSL1 HTT 4263/4885HPGD 1710/4885MAPT 4616/4885

“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.