SCHEMBL2614933

SCHEMBL2614933

COc1ccc(-c2ccc(C)nc2)c(OC)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 3/20 0.48
BRD9 Q9H8M2 2/20 0.46
BRD7 Q9NPI1 2/20 0.46
ERN1 O75460 2/20 0.46
CYP2A6 P11509 1/20 0.45
POLQ O75417 1/20 0.44
POLB P06746 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
ATM Q13315 1/20 0.39
PIK3CA P42336 2/20 0.39
PIK3CD O00329 1/20 0.39
PIK3CB P42338 1/20 0.39
PIK3CG P48736 1/20 0.39
MKNK1 Q9BUB5 1/20 0.39
MKNK2 Q9HBH9 1/20 0.39
HSD17B1 P14061 1/20 0.38
HSD17B2 P37059 1/20 0.38
CYP1A2 P05177 1/20 0.38

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
SCHEMBL2609408 0.80 ERN1 (0.43) BRD9BRD7ERN1CYP2A6POLQ
SCHEMBL3564079 0.77 QPCT (0.53) PDE10ANPC1RAB9AATMPIK3CA
SCHEMBL2614940 0.77 CYP2A6 (0.58) PDE10AERN1CYP2A6PIK3CAPIK3CD
SCHEMBL17276010 0.76 BRD9 (0.56) PDE10ABRD9BRD7ERN1POLQ
SCHEMBL31438401 0.76 BRD9 (0.56) PDE10ABRD9BRD7ERN1POLQ
SCHEMBL13500512 0.76 BRD9 (0.47) BRD9BRD7ERN1POLBTDP1
SCHEMBL15984748 0.75 CYP2A6 (0.54) PDE10ACYP2A6PIK3CAPIK3CDPIK3CB
SCHEMBL2919816 0.75 PDE10A (0.49) PDE10ACYP2A6PIK3CAPIK3CDPIK3CB
SCHEMBL2037315 0.75 ERN1 (0.49) PDE10ABRD9BRD7ERN1POLQ
SCHEMBL2044532 0.73 POLB (0.57) BRD9BRD7ERN1POLBTDP1

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
EP-2379535-B1 7-PHENOXYCHROMAN CARBOXYLIC ACID DERIVATIVES ARRAY BIOPHARMA INC (US) 2016-06-15 EP disclosed
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 PDE10A 533/4885BRD9 2127/4885BRD7 838/4885

“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.