SCHEMBL3660770

SCHEMBL3660770

O=C(c1ccccc1)c1cc(C(F)(F)F)ccc1F

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 3/20 0.51
CNR2 P34972 2/20 0.48
P2RX1 P51575 1/20 0.47
CES2 O00748 2/20 0.47
CNR1 P21554 1/20 0.47
KCNK3 O14649 1/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
TRPV1 Q8NER1 1/20 0.46
HPGD P15428 2/20 0.46
GLA P06280 1/20 0.46
LMNA P02545 1/20 0.45
CYP2C8 P10632 1/20 0.44
ALDH1A1 P00352 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
KCNH2 Q12809 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
KDM4E B2RXH2 1/20 0.44
HSD17B10 Q99714 1/20 0.44

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
SCHEMBL29941444 1.00 SRD5A2 (0.51) SRD5A2CNR2P2RX1CES2CNR1
SCHEMBL1513062 0.87 KDM4E (0.56) SRD5A2CNR2P2RX1CES2CNR1
SCHEMBL5992479 0.83 CNR2 (0.55) SRD5A2CNR2P2RX1CES2CNR1
SCHEMBL3486347 0.83 MAPT (0.61) SRD5A2CNR2P2RX1CES2CNR1
SCHEMBL9537242 0.83 KDM4E (0.62) SRD5A2CNR2P2RX1CES2CNR1
SCHEMBL30070755 0.83 CNR2 (0.55) SRD5A2CNR2P2RX1CES2CNR1
SCHEMBL27353325 0.82 GLA (0.55) SRD5A2CNR2P2RX1CES2CNR1
SCHEMBL25850063 0.82 TAS2R14 (0.52) SRD5A2CNR2P2RX1CES2CNR1
SCHEMBL43771 0.80 ALDH1A1 (0.59) SRD5A2CES2HPGDALDH1A1MEN1
SCHEMBL29382489 0.80 ALDH1A1 (0.59) SRD5A2CES2HPGDALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9663476-B2 Glycine transporter-1 inhibitors AMGEN INC. (US) 2017-05-30 US disclosed
EP-2947067-A1 Glycine transporter-1 inhibitors Amgen, Inc (US) 2015-11-25 EP disclosed
US-20150307457-A1 GLYCINE TRANSPORTER-1 INHIBITORS AMGEN INC. (US) 2015-10-29 US disclosed
US-8735383-B2 Glycine transporter-1 inhibitors AMGEN INC. (US) 2014-05-27 US disclosed
EP-2041088-B1 GLYCINE TRANSPORTER-1 INHIBITORS AMGEN INC (US) 2014-01-08 EP disclosed
CN-102964233-A Synthetic method of 3, 5-difluoro trifluoromethyl benzophenone DALIAN JOIN KING BIOCHEM TECH CO LTD 2013-03-13 CN disclosed
CN-102964233-A Synthetic method of 3, 5-difluoro trifluoromethyl benzophenone DALIAN JOIN KING BIOCHEM TECH CO LTD 2013-03-13 CN disclosed
EP-2565183-A1 Glycine transporter-1 inhibitors Amgen Inc. (US) 2013-03-06 EP disclosed
CN-101479243-B Glycine transporter-1 inhibitors AMGEN INC 2013-01-02 CN disclosed
US-8258306-B2 Glycine transporter-1 inhibitors AMGEN INC. (US) 2012-09-04 US disclosed
WO-2002010137-A9 INDAZOLE DERIVATIVES AS JNK INHIBITORS SIGNAL PHARM INC (US) 2003-02-06 WO disclosed
US-20020103229-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto SIGNAL PHARMACEUTICALS, LLC 2002-08-01 US disclosed
WO-2002010137-A2 INDAZOLE DERIVATIVES AS JNK INHIBITORS SIGNAL PHARMACEUTICALS, INC. (US) 2002-02-07 WO disclosed
EP-0806411-B1 Anti-viral compounds LILLY CO ELI (US) 2001-07-11 EP disclosed
US-6127422-A INHIBITING AN ENVELOPE VIRUS SELECTED FROM THE GROUP CONSISTING OF INFLUENZA BOVINE DIARRHEAL, HEPATITIS C AND TICK BORNE ENCEPHALITIS VIRUS THAT UNDERGOES HEMAGGLUTININ MEDIATED FUSION WITH A HOST CELL; PHENANTHRENE ESTERS ELI LILLY AND COMPANY (US) 2000-10-03 US disclosed
US-6096917-A Anti-viral compounds ELI LILLY AND COMPANY (US) 2000-08-01 US disclosed
WO-1997041849-A1 ANTI-VIRAL METHOD ELI LILLY AND COMPANY (US) 1997-11-13 WO disclosed
WO-1997042154-A1 ANTI-VIRAL COMPOUNDS ELI LILLY AND COMPANY (US) 1997-11-13 WO disclosed
EP-0806203-A2 Anti-viral compositions ELI LILLY AND COMPANY (US) 1997-11-12 EP disclosed
EP-0806411-A2 Anti-viral compounds ELI LILLY AND COMPANY (US) 1997-11-12 EP 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 (2 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-20020103229-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto MAP3K7, MAP3K1, MAP3K8 SRD5A2 2761/4885CNR2 1608/4885P2RX1 2126/4885
US-20150307457-A1 GLYCINE TRANSPORTER-1 INHIBITORS SLC18A2, SLC7A11, SLC6A5 SRD5A2 2710/4885CNR2 1604/4885P2RX1 3017/4885

“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.