SCHEMBL3973924

SCHEMBL3973924

COc1ccc(-c2cc(C(=O)O)c(C)o2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.69
NPC1 O15118 4/20 0.69
RAB9A P51151 4/20 0.69
SMN1; SMN2 Q16637 4/20 0.69
HSD17B10 Q99714 4/20 0.69
KDM4E B2RXH2 3/20 0.69
MAPK1 P28482 1/20 0.69
HPGD P15428 6/20 0.64
MAPT P10636 3/20 0.64
POLB P06746 4/20 0.59
APEX1 P27695 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
TP53 P04637 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
NR4A2 P43354 1/20 0.55
EGFR P00533 1/20 0.54
RECQL P46063 1/20 0.54
MEN1 O00255 1/20 0.53
PKM P14618 1/20 0.53

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
SCHEMBL10517136 0.88 ALDH1A1 (0.64) ALDH1A1NPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL3102333 0.86 ALDH1A1 (0.62) ALDH1A1NPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL28139604 0.84 ALDH1A1 (0.64) ALDH1A1NPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL381400 0.84 ALDH1A1 (0.64) ALDH1A1NPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL29742792 0.84 ALDH1A1 (0.64) ALDH1A1NPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL3978878 0.82 NPC1 (0.61) ALDH1A1NPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL3914342 0.82 NPC1 (0.61) ALDH1A1NPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL29859324 0.82 TARBP2 (0.55) ALDH1A1NPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL3932665 0.82 GPR35 (0.55) ALDH1A1NPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL557753 0.82 NPC1 (0.73) ALDH1A1NPC1RAB9ASMN1; SMN2HSD17B10

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3549930-B1 NOVEL ESTER COMPOUND AND PIN1 INHIBITOR, INFLAMMATORY DISEASE THERAPEUTIC, AND COLON CANCER THERAPEUTIC IN WHICH SAID ESTER COMPOUND IS USED UNIV HIROSHIMA (JP) 2023-07-19 EP disclosed
EP-3549930-B1 NOVEL ESTER COMPOUND AND PIN1 INHIBITOR, INFLAMMATORY DISEASE THERAPEUTIC, AND COLON CANCER THERAPEUTIC IN WHICH SAID ESTER COMPOUND IS USED UNIV HIROSHIMA (JP) 2023-07-19 EP disclosed
US-11203565-B2 Ester compound and PIN1 inhibitor, inflammatory disease therapeutic, and colon cancer therapeutic in which said ester compound is used HIROSHIMA UNIVERSITY (JP) 2021-12-21 US disclosed
EP-3549930-A1 NOVEL ESTER COMPOUND AND PIN1 INHIBITOR, INFLAMMATORY DISEASE THERAPEUTIC, AND COLON CANCER THERAPEUTIC IN WHICH SAID ESTER COMPOUND IS USED Hiroshima University (JP) 2019-10-09 EP disclosed
EP-3549930-A1 NOVEL ESTER COMPOUND AND PIN1 INHIBITOR, INFLAMMATORY DISEASE THERAPEUTIC, AND COLON CANCER THERAPEUTIC IN WHICH SAID ESTER COMPOUND IS USED Hiroshima University (JP) 2019-10-09 EP disclosed
US-7569602-B2 Furan derivatives as EP4 receptor antagonists ASTERAND UK LIMITED (GB) 2009-08-04 US disclosed
US-7569602-B2 Furan derivatives as EP4 receptor antagonists ASTERAND UK LIMITED (GB) 2009-08-04 US disclosed
EP-1673360-B1 FURAN DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS ASTERAND UK LTD (GB) 2008-12-17 EP disclosed
EP-1673360-B1 FURAN DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS ASTERAND UK LTD (GB) 2008-12-17 EP disclosed
US-20080306117-A1 EP4 RECEPTOR ANTAGONISTS ASTERAND UK LIMITED (GB) 2008-12-11 US disclosed
US-20080306117-A1 EP4 RECEPTOR ANTAGONISTS ASTERAND UK LIMITED (GB) 2008-12-11 US disclosed
US-7417068-B2 EP4 receptor antagonists ASTERAND UK LIMITED (GB) 2008-08-26 US disclosed
US-7417068-B2 EP4 receptor antagonists ASTERAND UK LIMITED (GB) 2008-08-26 US disclosed
US-7417068-B2 EP4 receptor antagonists ASTERAND UK LIMITED (GB) 2008-08-26 US disclosed
US-20070135503-A1 Furan derivatives as ep4 receptor antagonists ASTERAND UK ACQUISITION LIMITED (GB) 2007-06-14 US disclosed
US-20070135503-A1 Furan derivatives as ep4 receptor antagonists ASTERAND UK ACQUISITION LIMITED (GB) 2007-06-14 US disclosed
US-20070135503-A1 Furan derivatives as ep4 receptor antagonists ASTERAND UK ACQUISITION LIMITED (GB) 2007-06-14 US disclosed
EP-1673360-A1 FURAN DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS ASTERAND UK LIMITED (GB) 2006-06-28 EP disclosed
US-20050124676-A1 EP4 receptor antagonists ASTERAND UK ACQUISITION LIMITED (GB) 2005-06-09 US disclosed
WO-2005037812-A1 FURAN DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS ASTERAND UK LIMITED (GB) 2005-04-28 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 (4 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-20050124676-A1 EP4 receptor antagonists PTGER4, PTGER3, NR4A3 ALDH1A1 2257/4885NPC1 2821/4885RAB9A 4505/4885
US-20080306117-A1 EP4 RECEPTOR ANTAGONISTS PTGER4, PTGER3, NR4A3 ALDH1A1 2257/4885NPC1 2821/4885RAB9A 4505/4885
US-20070135503-A1 Furan derivatives as ep4 receptor antagonists PTGER4, PTGER3, NR4A3 ALDH1A1 2241/4885NPC1 3071/4885RAB9A 4373/4885
US-11203565-B2 Ester compound and PIN1 inhibitor, inflammatory disease therapeutic, and colon cancer therapeutic in which said ester compound is used PIN1, APC, GSKIP ALDH1A1 3207/4885NPC1 71/4885RAB9A 3650/4885

“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.