SCHEMBL2933945

SCHEMBL2933945

COc1ccccc1COc1cc(C(=O)O)cc2cc(OCc3c(C)cccc3C)ccc12

nearest known ligand 0.76

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.45
P2RY14 Q15391 1/20 0.45
PARP10 Q53GL7 2/20 0.44
PARP14 Q460N5 1/20 0.44
LTB4R Q15722 1/20 0.44
LTB4R2 Q9NPC1 1/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
SLC26A4 O43511 1/20 0.44
ALKBH1 Q13686 1/20 0.43
PARP15 Q460N3 1/20 0.43
CSNK2A2 P19784 1/20 0.42
CSNK2A1 P68400 1/20 0.42
MRGPRX4 Q96LA9 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
PTGER4 P35408 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
SCHEMBL2931653 0.90 PARP10 (0.42) RECQLPARP10PARP14MEN1KMT2A
SCHEMBL2932687 0.87 P2RY14 (0.60) P2RY14LTB4RLTB4R2MEN1KMT2A
SCHEMBL13057713 0.84 P2RY14 (0.48) P2RY14LTB4RLTB4R2MRGPRX4
SCHEMBL13057709 0.81 P2RY14 (0.53) P2RY14LTB4RLTB4R2MEN1KMT2A
SCHEMBL13807483 0.76 P2RY14 (0.48) P2RY14LTB4RLTB4R2MRGPRX4
SCHEMBL6204953 0.75 P2RY14 (0.61) P2RY14LTB4RLTB4R2MEN1KMT2A
SCHEMBL2934240 0.75 P2RY14 (0.65) P2RY14LTB4RLTB4R2MRGPRX4
SCHEMBL13057712 0.75 ALDH1A1 (0.43) MEN1KMT2AL3MBTL1
SCHEMBL2927190 0.74 P2RY14 (0.64) P2RY14LTB4RLTB4R2MRGPRX4PTGER4
SCHEMBL10690676 0.73 L3MBTL1 (0.65) PARP10PARP14MEN1KMT2AALKBH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100298347-A1 SUBSTITUTED 2-NAPHTHOIC ACIDS AS ANTAGONISTS OF GPR105 ACTIVITY MERCK FROSST CANADA LTD (CA) 2010-11-25 US disclosed
US-20100298347-A1 SUBSTITUTED 2-NAPHTHOIC ACIDS AS ANTAGONISTS OF GPR105 ACTIVITY MERCK FROSST CANADA LTD (CA) 2010-11-25 US disclosed
US-20100298347-A1 SUBSTITUTED 2-NAPHTHOIC ACIDS AS ANTAGONISTS OF GPR105 ACTIVITY MERCK FROSST CANADA LTD (CA) 2010-11-25 US disclosed
EP-2229373-A1 SUBSTITUTED 2-NAPHTHOIC ACIDS AS ANTAGONISTS OF GPR105 ACTIVITY Merck Frosst Canada Ltd. (CA) 2010-09-22 EP disclosed
WO-2009070873-A1 SUBSTITUTED 2-NAPHTHOIC ACIDS AS ANTAGONISTS OF GPR105 ACTIVITY MERCK FROSST CANADA LTD. (CA) 2009-06-11 WO disclosed
WO-2009070873-A1 SUBSTITUTED 2-NAPHTHOIC ACIDS AS ANTAGONISTS OF GPR105 ACTIVITY MERCK FROSST CANADA LTD. (CA) 2009-06-11 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-20100298347-A1 SUBSTITUTED 2-NAPHTHOIC ACIDS AS ANTAGONISTS OF GPR105 ACTIVITY GPR119, GPR52, GPR35 RECQL 4226/4885P2RY14 423/4885PARP10 1788/4885

“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.