SCHEMBL2614973

SCHEMBL2614973

Cc1cccc(-c2ccc(Cl)c(C(F)(F)F)c2)n1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 11/20 0.51
CTSS P25774 2/20 0.47
CTSK P43235 1/20 0.47
CCR1 P32246 1/20 0.44
CCR8 P51685 1/20 0.44
COMT P21964 1/20 0.43
KDR P35968 1/20 0.42
EPHB4 P54760 1/20 0.42
TEK Q02763 1/20 0.42
GRM2 Q14416 1/20 0.42
CYP1A2 P05177 1/20 0.42
KCNH2 Q12809 1/20 0.41
RAF1 P04049 1/20 0.41
BRAF P15056 1/20 0.41
CYP2A6 P11509 1/20 0.41

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
SCHEMBL17788165 0.82 HSD17B1 (0.52) CTSSCTSKCCR1CCR8CYP2A6
SCHEMBL2609335 0.81 NOTUM (0.48) NOTUMCTSSCTSKKDREPHB4
SCHEMBL2615270 0.80 CCR1 (0.54) CCR1CCR8CYP1A2CYP2A6
SCHEMBL2615821 0.80 CCR1 (0.48) CCR1CCR8CYP2A6
SCHEMBL16385227 0.79 CTSS (0.51) CTSSCTSKCCR1CCR8
SCHEMBL16419582 0.77 CCR1 (0.46) CCR1CCR8CYP2A6
SCHEMBL16421508 0.76 CCR1 (0.52) CCR1CCR8KDREPHB4TEK
SCHEMBL4026680 0.75 NOTUM (0.54) NOTUMCTSSCTSKCYP1A2
SCHEMBL19627015 0.75 RECQL (0.51) NOTUMCTSSCTSK
SCHEMBL2666240 0.75 NOTUM (0.50) NOTUMCTSSCTSKCOMTGRM2

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 2 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

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 NOTUM 3379/4885CTSS 2690/4885CTSK 1843/4885

“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.