SCHEMBL3300692

SCHEMBL3300692

Fc1cccc(Cc2cccc(F)c2F)c1F

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MPO P05164 1/20 0.47
GPR84 Q9NQS5 3/20 0.43
FFAR1 O14842 1/20 0.43
TAAR1 Q96RJ0 3/20 0.42
CES2 O00748 2/20 0.41
CES1 P23141 2/20 0.41
BCHE P06276 1/20 0.41
RIPK1 Q13546 1/20 0.40
IDO1 P14902 2/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
AKR1B1 P15121 1/20 0.39
HSPA5 P11021 1/20 0.36
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
GABRA1 P14867 1/20 0.35
GABRB2 P47870 1/20 0.35

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
SCHEMBL16933910 0.85 ACHE (0.48) MPOTAAR1RIPK1ADORA2AADORA1
SCHEMBL3306943 0.84 HTR2A (0.50) MPOTAAR1LMNAGAA
SCHEMBL7052559 0.83 TAAR1 (0.48) MPOTAAR1CES2CES1BCHE
SCHEMBL21662616 0.83 MPO (0.42) MPOGPR84FFAR1TAAR1RIPK1
SCHEMBL17552658 0.81 TAAR1 (0.41) MPOGPR84FFAR1TAAR1CES2
SCHEMBL283845 0.81 TAAR1 (0.41) MPOGPR84FFAR1TAAR1CES2
SCHEMBL214409 0.81 TAAR1 (0.52) MPOTAAR1CES2CES1BCHE
SCHEMBL12815296 0.80 MPO (0.40) MPOGPR84FFAR1TAAR1RIPK1
SCHEMBL10476233 0.80 MAOB (0.50) MPOTAAR1IDO1
Hydrochloric Acid SCHEMBL11299004 0.79 IDO1 (0.40) MPOTAAR1CES2CES1BCHE

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8492384-B2 Imidazolylalkylcarbonyl derivatives as calcium channel modulators and preparation method thereof KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2013-07-23 US claimed
US-20090325979-A1 NOVEL IMIDAZOLYLALKYLCARBONYL DERIVATIVES AS CALCIUM CHANNEL MODULATORS AND PREPARATION METHOD THEREOF KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2009-12-31 US claimed
CN-109411805-B Electrolyte and lithium secondary battery including the same 三星电子株式会社 2023-07-11 CN disclosed
US-20170338504-A1 POLYMER AND POLYMER ELECTROLYTE MEMBRANE COMPRISING SAME LG CHEM, LTD. (KR) 2017-11-23 US disclosed
US-20170327607-A1 POLYMER AND POLYMER ELECTROLYTE MEMBRANE COMPRISING SAME LG CHEM, LTD. (KR) 2017-11-16 US disclosed
US-20170331136-A1 POLYMER ELECTROLYTE MEMBRANE LG CHEM, LTD. (KR) 2017-11-16 US disclosed
US-20170317370-A1 POLYMER AND POLYMER ELECTROLYTE MEMBRANE COMPRISING SAME LG CHEM, LTD. (KR) 2017-11-02 US disclosed
US-8492384-B2 Imidazolylalkylcarbonyl derivatives as calcium channel modulators and preparation method thereof KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2013-07-23 US disclosed
US-8299072-B2 Pyrazolylmethylamine compounds as calcium channel modulators and preparation method thereof KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2012-10-30 US disclosed
US-20100094006-A1 NOVEL PYRAZOLYLMETHYLAMINE COMPOUNDS AS CALCIUM CHANNEL MODULATORS AND PREPARATION METHOD THEREOF KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2010-04-15 US disclosed
US-20090325979-A1 NOVEL IMIDAZOLYLALKYLCARBONYL DERIVATIVES AS CALCIUM CHANNEL MODULATORS AND PREPARATION METHOD THEREOF KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2009-12-31 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 (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-20090325979-A1 NOVEL IMIDAZOLYLALKYLCARBONYL DERIVATIVES AS CALCIUM CHANNEL MODULATORS AND PREPARATION METHOD THEREOF CACNA1B, CACNA1C, ORAI1 MPO 4413/4885GPR84 2440/4885FFAR1 1462/4885
US-20100094006-A1 NOVEL PYRAZOLYLMETHYLAMINE COMPOUNDS AS CALCIUM CHANNEL MODULATORS AND PREPARATION METHOD THEREOF CACNA1I, CACNA1C, ORAI1 MPO 4639/4885GPR84 920/4885FFAR1 2156/4885

“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.