SCHEMBL1503496

SCHEMBL1503496

CCC(c1ccccc1)c1nccn1C

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.63
MAPT P10636 1/20 0.48
CYP2D6 P10635 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
KMT2A Q03164 3/20 0.43
MEN1 O00255 1/20 0.43
FFAR1 O14842 3/20 0.41
CNR1 P21554 1/20 0.41
TSHR P16473 2/20 0.39
CYP19A1 P11511 1/20 0.39

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
SCHEMBL4057810 0.85 KDM4E (0.50) KDM4EMAPTCYP2D6L3MBTL1KMT2A
Trifluoromethanesulfonic Acid SCHEMBL28182343 0.85 KDM4E (0.51) KDM4EMAPTCYP2D6L3MBTL1KMT2A
Hydrochloric Acid SCHEMBL29054526 0.80 KDM4E (0.55) KDM4EMAPTCYP2D6L3MBTL1KMT2A
Bromide SCHEMBL29054561 0.80 KDM4E (0.55) KDM4EMAPTCYP2D6L3MBTL1KMT2A
SCHEMBL3401057 0.79 KDM4E (0.67) KDM4EMAPTCYP2D6L3MBTL1KMT2A
SCHEMBL28215659 0.78 KDM4E (0.56) KDM4EMAPTCYP2D6L3MBTL1KMT2A
SCHEMBL5299480 0.77 TLR8 (0.48) KDM4EKMT2AMEN1
SCHEMBL950298 0.77 KDM4E (0.65) KDM4EMAPTCYP2D6L3MBTL1KMT2A
Hydrochloric Acid SCHEMBL29054527 0.77 KDM4E (0.65) KDM4EMAPTCYP2D6L3MBTL1KMT2A
SCHEMBL30824582 0.77 KDM4E (0.65) KDM4EMAPTCYP2D6L3MBTL1KMT2A

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 102 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1984438-B2 ANTISTATIC POLYURETHANE BASF SE (DE) 2016-05-18 EP claimed
US-20150057388-A1 ANTISTATIC POLYURETHANE BASF SE (DE) 2015-02-26 US claimed
EP-1812382-B1 METHOD FOR PRODUCING POLYISOCYANATES BASF SE (DE) 2013-01-23 EP claimed
JP-4794561-B2 2011-10-19 JP claimed
EP-1984438-B1 ANTISTATIC POLYURETHANE BASF SE (DE) 2010-03-31 EP claimed
US-7659430-B2 Method for separating hydrogen chloride and phosgene BASF AKTIENGESELLSCHAFT (DE) 2010-02-09 US claimed
US-20090300946-A1 ANTISTATIC POLYURETHANE BASF SE (DE) 2009-12-10 US claimed
EP-1789160-B1 METHOD FOR SEPARATING HYDROGEN CHLORIDE AND PHOSGENE BASF SE (DE) 2009-11-18 EP claimed
US-20090112017-A1 METHOD FOR PRODUCING POLYISOCYANATES BASF AKTIENGESSELLSCHAFT (DE) 2009-04-30 US claimed
CN-101410444-A Antistatic polyurethane BASF SE (DE) 2009-04-15 CN claimed
CN-101056848-A Process for preparing polyisocyanates BASF AG (DE) 2007-10-17 CN claimed
WO-2007090755-A1 ANTISTATIC POLYURETHANE BASF AKTIENGESELLSCHAFT (DE) 2007-08-16 WO claimed
EP-1812382-A1 METHOD FOR PRODUCING POLYISOCYANATES BASF AKTIENGESELLSCHAFT (DE) 2007-08-01 EP claimed
EP-1805206-A2 ELECTROCHEMICAL DEBLOCKING USING A HYDRAZINE DERIVATIVE Combimatrix Corporation (US) 2007-07-11 EP claimed
EP-1789160-A1 METHOD FOR SEPARATING HYDROGEN CHLORIDE AND PHOSGENE BASF AKTIENGESELLSCHAFT (DE) 2007-05-30 EP claimed
WO-2007006418-A1 IONIC-LIQUID-CONTAINING PRODUCTS FOR DYEING AND/OR BRIGHTENING KERATIN FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-01-18 WO claimed
WO-2006131234-A1 COSMETIC COMPOSITIONS COMPRISING IONIC LIQUIDS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-12-14 WO claimed
WO-2006048171-A1 METHOD FOR PRODUCING POLYISOCYANATES BASF AKTIENGESELLSCHAFT (DE) 2006-05-11 WO claimed
WO-2006029788-A1 METHOD FOR SEPARATING HYDROGEN CHLORIDE AND PHOSGENE BASF AKTIENGESELLSCHAFT (DE) 2006-03-23 WO claimed
WO-2006031814-A2 ELECTROCHEMICAL DEBLOCKING USING A HYDRAZINE DERIVATIVE COMBIMATRIX CORPORATION (US) 2006-03-23 WO claimed

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-20090112017-A1 METHOD FOR PRODUCING POLYISOCYANATES PGLS, INMT, PNMT KDM4E 3386/4885MAPT 1739/4885CYP2D6 2045/4885

“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.