SCHEMBL492736

SCHEMBL492736

FC(F)(F)c1ccc(COCc2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.68
KMT2A Q03164 1/20 0.57
MAOB P27338 7/20 0.55
TAAR1 Q96RJ0 1/20 0.52
TACR1 P25103 1/20 0.47
PTPN2 P17706 1/20 0.47
PTPN1 P18031 1/20 0.47
PTPN6 P29350 1/20 0.47
TSHR P16473 1/20 0.46
ALDH1A1 P00352 2/20 0.46

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
Hydroxyamine SCHEMBL8924228 0.93 IDO1 (0.67) IDO1KMT2AMAOBTAAR1PTPN2
SCHEMBL5780375 0.89 IDO1 (0.57) IDO1KMT2AMAOBTAAR1TACR1
SCHEMBL668193 0.89 IDO1 (0.57) IDO1KMT2AMAOBTAAR1TACR1
SCHEMBL8076361 0.87 IDO1 (0.59) IDO1KMT2AMAOBTAAR1TACR1
SCHEMBL3434078 0.87 IDO1 (0.59) IDO1KMT2AMAOBTAAR1TACR1
SCHEMBL1771605 0.87 IDO1 (0.59) IDO1KMT2AMAOBTAAR1TACR1
SCHEMBL29226719 0.87 IDO1 (0.59) IDO1KMT2AMAOBTAAR1TACR1
SCHEMBL10458621 0.85 IDO1 (0.57) IDO1KMT2AMAOBTAAR1TACR1
SCHEMBL17298962 0.84 MGLL (0.68) IDO1KMT2AMAOBPTPN2PTPN1
SCHEMBL2399721 0.84 TRPV6 (0.68) IDO1KMT2AMAOBTAAR1TACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1546162-B1 LUMINESCENCE-BASED METHODS AND PROBES FOR MEASURING CYTOCHROME P450 ACTIVITY PROMEGA CORP (US) 2011-06-22 EP claimed
US-7692022-B2 Using luciferin derivatives for analyzing metabolic activity in animals, cells or in cell-free reaction formulations PROMEGA CORPORATION (US) 2010-04-06 US claimed
EP-1546162-A4 LUMINESCENCE-BASED METHODS AND PROBES FOR MEASURING CYTOCHROME P450 ACTIVITY PROMEGA CORP (US) 2007-07-18 EP claimed
EP-1546162-A2 LUMINESCENCE-BASED METHODS AND PROBES FOR MEASURING CYTOCHROME P450 ACTIVITY PROMEGA CORPORATION (US) 2005-06-29 EP claimed
US-20040171099-A1 Using luciferin derivatives for analyzing metabolic activity in animals, cells or in cell-free reaction formulations PROMEGA CORPORATION 2004-09-02 US claimed
WO-2004027378-A2 LUMINESCENCE-BASED METHODS AND PROBES FOR MEASURING CYTOCHROME P450 ACTIVITY PROMEGA CORPORATION (US) 2004-04-01 WO claimed
US-10408819-B2 Luminescence-based methods and probes for measuring cytochrome P450 activity PROMEGA CORPORATION (US) 2019-09-10 US disclosed
US-20170191985-A1 LUMINESCENCE-BASED METHODS AND PROBES FOR MEASURING CYTOCHROME P450 ACTIVITY JPMORGAN CHASE BANK, N.A., AS COLLATERAL AGENT 2017-07-06 US disclosed
US-9574223-B2 Luminescence-based methods and probes for measuring cytochrome P450 activity PROMEGA CORPORATION (US) 2017-02-21 US disclosed
US-20140380514-A1 LUMINESCENCE-BASED METHODS AND PROBES FOR MEASURING CYTOCHROME P450 ACTIVITY JPMORGAN CHASE BANK, N.A., AS COLLATERAL AGENT 2014-12-25 US disclosed
US-8765969-B2 Luminescence-based methods and probes for measuring cytochrome P450 activity PROMEGA CORPORATION (US) 2014-07-01 US disclosed
US-8106052-B2 Luminescence-based methods and probes for measuring cytochrome P450 activity PROMEGA CORPORATION (US) 2012-01-31 US disclosed
EP-1546162-B1 LUMINESCENCE-BASED METHODS AND PROBES FOR MEASURING CYTOCHROME P450 ACTIVITY PROMEGA CORP (US) 2011-06-22 EP disclosed
US-20020040136-A1 Vitronectin receptor antagonist SMITHKLINE BEECHAM CORPORATION 2002-04-04 US disclosed
US-20010014737-A1 Vitronectin receptor antagonist HEERDING DIRK (US) 2001-08-16 US disclosed
EP-1017387-A1 VITRONECTIN RECEPTOR ANTAGONIST SMITHKLINE BEECHAM CORPORATION (US) 2000-07-12 EP disclosed
EP-0957917-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1999-11-24 EP disclosed
WO-1999015170-A1 VITRONECTIN RECEPTOR ANTAGONIST SMITHKLINE BEECHAM CORPORATION (US) 1999-04-01 WO disclosed
WO-1998014192-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1998-04-09 WO disclosed
US-4169152-A Isohexide and tetrahydrofuran ethers and their carbamates in method of bringing about relaxation of skeletal musculature ICI AMERICAS INC. (US) 1979-09-25 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 (4 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-20020040136-A1 Vitronectin receptor antagonist CALCR, ADGRF1, CALCRL IDO1 4221/4885KMT2A 4439/4885MAOB 3271/4885
US-20140380514-A1 LUMINESCENCE-BASED METHODS AND PROBES FOR MEASURING CYTOCHROME P450 ACTIVITY CYP3A43, CYP3A7, CYP3A5 IDO1 718/4885KMT2A 4413/4885MAOB 241/4885
US-20010014737-A1 Vitronectin receptor antagonist CALCR, ADGRF1, CALCRL IDO1 4221/4885KMT2A 4439/4885MAOB 3271/4885
US-10408819-B2 Luminescence-based methods and probes for measuring cytochrome P450 activity CYP3A7, CYP3A43, CYP3A5 IDO1 593/4885KMT2A 3905/4885MAOB 187/4885

“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.