SCHEMBL487289

SCHEMBL487289

Cc1cc(C)c(C([O])=O)c(C)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
MAPT P10636 2/20 0.43
MAPK1 P28482 1/20 0.43
TAS1R3 Q7RTX0 3/20 0.42
TAS1R1 Q7RTX1 3/20 0.42
TAS1R2 Q8TE23 3/20 0.42
KDM4E B2RXH2 3/20 0.41
LMNA P02545 3/20 0.41
HPGD P15428 2/20 0.41
KMT2A Q03164 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MCOLN3 Q8TDD5 1/20 0.41
TPMT P51580 1/20 0.40
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
MMP1 P03956 1/20 0.38
MMP2 P08253 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
Phosphine SCHEMBL28028999 0.97 ALDH1A1 (0.42) ALDH1A1MAPTMAPK1TAS1R3TAS1R1
Biphenyl SCHEMBL27683906 0.83 SMN1; SMN2 (0.43) ALDH1A1MAPTLMNAKMT2AMEN1
Bicarbonate SCHEMBL7975060 0.81 KDM4E (0.53) ALDH1A1MAPTMAPK1TAS1R3TAS1R1
SCHEMBL31162472 0.81 TAS1R3 (0.41) ALDH1A1MAPTMAPK1TAS1R3TAS1R1
SCHEMBL22109937 0.80 HPGD (0.47) ALDH1A1MAPTMAPK1TAS1R3TAS1R1
SCHEMBL6666412 0.80 HPGD (0.52) ALDH1A1MAPTMAPK1TAS1R3TAS1R1
SCHEMBL29565638 0.78 TAS1R3 (0.42) ALDH1A1MAPTMAPK1TAS1R3TAS1R1
SCHEMBL21870 0.78 KDM4E (0.55) ALDH1A1MAPTMAPK1TAS1R3TAS1R1
SCHEMBL377596 0.78 KDM4E (0.55) ALDH1A1MAPTMAPK1TAS1R3TAS1R1
SCHEMBL698413 0.78 KDM4E (0.46) ALDH1A1MAPTMAPK1TAS1R3TAS1R1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110982157-A Low-odor rapid UV-LED ultraviolet light crosslinked polyethylene insulating material and preparation method thereof 上海新上化高分子材料有限公司 2020-04-10 CN claimed
CN-108948393-A A kind of antistatic UV hardening bath and its preparation and application method 无锡卓宇兴盛光电科技有限公司 2018-12-07 CN claimed
CN-107858081-A A kind of uV curable showering low luster coating composition and preparation method thereof 苏州市明大高分子科技材料有限公司 2018-03-30 CN claimed
CN-106751349-A A kind of radical cation hybrid UV-curing resin and preparation method and application 中山大简高分子材料有限公司 2017-05-31 CN claimed
EP-0343911-A2 Cycloalkyl-substituted glutaramide diuretic agents Pfizer Limited (GB) 1989-11-29 EP claimed
WO-2022065424-A1 CARCINOSTATIC AGENT, CARCINOGENESIS INHIBITOR AND LIFE-PROLONGING AGENT, COMPRISING NOVEL COMPOUND WITH MTORC1 INHIBITORY EFFECT 国立研究開発法人理化学研究所 2022-03-31 WO disclosed
EP-3564232-B1 BMP-SIGNAL-INHIBITING COMPOUND RIKEN (JP) 2022-01-26 EP disclosed
US-10954216-B2 BMP-signal-inhibiting compound RIKEN (JP) 2021-03-23 US disclosed
CN-110982157-A Low-odor rapid UV-LED ultraviolet light crosslinked polyethylene insulating material and preparation method thereof 上海新上化高分子材料有限公司 2020-04-10 CN disclosed
CN-110431189-A addition-curable silicone composition SHINETSU CHEMICAL CO 2019-11-08 CN disclosed
US-20190337926-A1 BMP-SIGNAL-INHIBITING COMPOUND RIKEN (JP) 2019-11-07 US disclosed
EP-3564232-A1 BMP-SIGNAL-INHIBITING COMPOUND Riken (JP) 2019-11-06 EP disclosed
EP-0214708-B1 GRISEOLIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE SANKYO COMPANY LIMITED (JP) 1989-12-13 EP disclosed
EP-0319316-A2 Griseolic acid monoesters, their preparation and use SANKYO COMPANY LIMITED (JP) 1989-06-07 EP disclosed
EP-0319050-A2 Griseolic acid derivatives, their preparation and their use SANKYO COMPANY LIMITED (JP) 1989-06-07 EP disclosed
EP-0318060-A2 Griseolic acid derivatives, their preparation and their use Sankyo Company Limited (JP) 1989-05-31 EP disclosed
EP-0251827-A2 New cyclic ether derivatives, their preparation and their use Sankyo Company Limited (JP) 1988-01-07 EP disclosed
EP-0214708-A2 Griseolic acid derivatives, their preparation and their use SANKYO COMPANY LIMITED (JP) 1987-03-18 EP disclosed
EP-0180188-A2 A composition for increasing the anti-cancer activity of an anti-cancer compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-05-07 EP disclosed
US-3936462-A CNS DEPRESSANT, ANALGESIC STERLING DRUG INC. (US) 1976-02-03 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 (2 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-10954216-B2 BMP-signal-inhibiting compound BMP1, BMP2, BMP4 ALDH1A1 4324/4885MAPT 4782/4885MAPK1 72/4885
US-20190337926-A1 BMP-SIGNAL-INHIBITING COMPOUND BMP1, BMP2, BMPR2 ALDH1A1 4102/4885MAPT 4243/4885MAPK1 165/4885

“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.