SCHEMBL9987456

SCHEMBL9987456

ClCc1nc2ccccc2[nH]1.Oc1nc2ccccc2[nH]1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DDAH1 O94760 1/20 0.54
POLB P06746 1/20 0.54
GAA P10253 2/20 0.51
NPC1 O15118 4/20 0.50
RAB9A P51151 4/20 0.50
BCHE P06276 1/20 0.50
CHRM1 P11229 1/20 0.50
PKM P14618 2/20 0.49
MAPT P10636 2/20 0.49
LMNA P02545 1/20 0.49
HTT P42858 1/20 0.49
HKDC1 Q2TB90 1/20 0.49
CYP1A2 P05177 2/20 0.48
CYP3A4 P08684 2/20 0.48
CYP2D6 P10635 2/20 0.48
CYP2C9 P11712 2/20 0.48
CYP2C19 P33261 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
SMN1; SMN2 Q16637 3/20 0.47
TP53 P04637 1/20 0.47

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
SCHEMBL119941 0.89 DDAH1 (0.66) DDAH1POLBGAANPC1RAB9A
Hydrochloric Acid SCHEMBL5263367 0.88 DDAH1 (0.63) DDAH1POLBGAANPC1RAB9A
SCHEMBL29437860 0.84 ALDH1A1 (0.60) DDAH1POLBGAANPC1RAB9A
SCHEMBL75450 0.84 ALDH1A1 (0.60) DDAH1POLBGAANPC1RAB9A
Fluoride SCHEMBL31379740 0.82 ALDH1A1 (0.58) DDAH1POLBGAANPC1RAB9A
Pyrrole SCHEMBL5553963 0.79 NPC1 (0.50) DDAH1POLBGAANPC1RAB9A
Guanidine SCHEMBL4196964 0.75 ALDH1A1 (0.52) POLBGAANPC1RAB9APKM
SCHEMBL4065464 0.75 POLB (0.72) DDAH1POLBGAANPC1RAB9A
SCHEMBL231417 0.74 DDAH1 (0.66) DDAH1POLBGAANPC1RAB9A
SCHEMBL7697312 0.74 GAA (0.53) DDAH1POLBGAANPC1RAB9A

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-20130165564-A1 METAL PHOSPHONATE FLAME RETARDANT AND METHOD PRODUCING THEREOF ICL-IP AMERICA INC. (US) 2013-06-27 US claimed
EP-2585473-A2 METAL PHOSPHONATE FLAME RETARDANT AND METHOD PRODUCING THEREOF ICL-IP America Inc. (US) 2013-05-01 EP claimed
WO-2011163207-A2 METAL PHOSPHONATE FLAME RETARDANT AND METHOD PRODUCING THEREOF ICL-IP AMERICA INC. (US) 2011-12-29 WO claimed
EP-2585473-B1 METAL PHOSPHONATE FLAME RETARDANT AND METHOD PRODUCING THEREOF ICL IP AMERICA INC (US) 2015-09-23 EP disclosed
US-20130165564-A1 METAL PHOSPHONATE FLAME RETARDANT AND METHOD PRODUCING THEREOF ICL-IP AMERICA INC. (US) 2013-06-27 US disclosed
EP-2585473-A2 METAL PHOSPHONATE FLAME RETARDANT AND METHOD PRODUCING THEREOF ICL-IP America Inc. (US) 2013-05-01 EP disclosed
WO-2011163207-A2 METAL PHOSPHONATE FLAME RETARDANT AND METHOD PRODUCING THEREOF ICL-IP AMERICA INC. (US) 2011-12-29 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-20130165564-A1 METAL PHOSPHONATE FLAME RETARDANT AND METHOD PRODUCING THEREOF MTAP, AS3MT, MPHOSPH6 DDAH1 1049/4885POLB 257/4885GAA 2305/4885

“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.