SCHEMBL2615355

SCHEMBL2615355

Cc1ccc(-c2ccc(C(F)(F)F)cc2F)nn1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MPL P40238 2/20 0.50
HSD11B1 P28845 1/20 0.47
FEN1 P39748 7/20 0.45
ALOX5AP P20292 7/20 0.45
CYP1A2 P05177 2/20 0.42
APP P05067 1/20 0.39
PDE2A O00408 1/20 0.38
CYP11B2 P19099 3/20 0.38
IDO1 P14902 1/20 0.37
CYP11B1 P15538 2/20 0.36
GRM2 Q14416 1/20 0.36

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
SCHEMBL3204474 0.84 KCNH2 (0.42) MPLHSD11B1FEN1ALOX5APCYP1A2
SCHEMBL2615844 0.83 HSD11B1 (0.43) HSD11B1CYP1A2PDE2AGRM2
SCHEMBL18908816 0.81 MPL (0.48) MPLHSD11B1FEN1ALOX5APAPP
SCHEMBL2131399 0.81 MPL (0.57) MPLHSD11B1FEN1ALOX5APIDO1
SCHEMBL25400896 0.80 TP53 (0.48) FEN1ALOX5APCYP1A2PDE2A
SCHEMBL2609368 0.80 MPL (0.47) MPLHSD11B1FEN1ALOX5APAPP
SCHEMBL13265493 0.80 CYP1A2 (0.39) MPLHSD11B1FEN1ALOX5APCYP1A2
SCHEMBL31399815 0.80 TP53 (0.48) FEN1ALOX5APCYP1A2PDE2A
SCHEMBL13273285 0.80 ALPL (0.43) CYP11B2CYP11B1
SCHEMBL2615352 0.77 KMO (0.43) HSD11B1GRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8785445-B2 7-phenoxychroman carboxylic acid derivatives ARRAY BIOPHARMA INC. (US) 2014-07-22 US disclosed
US-20120101103-A1 7-PHENOXYCHROMAN CARBOXYLIC ACID DERIVATIVES ARRAY BIOPHARMA INC. (US) 2012-04-26 US disclosed
WO-2010075200-A1 7-PHENOXYCHROMAN CARBOXYLIC ACID DERIVATIVES ARRAY BIOPHARMA INC. (US) 2010-07-01 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-20120101103-A1 7-PHENOXYCHROMAN CARBOXYLIC ACID DERIVATIVES PTGDR2, PTGDR, HRH2 MPL 1072/4885HSD11B1 541/4885FEN1 4589/4885

“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.