SCHEMBL2990957

SCHEMBL2990957

CCC(O)c1ccccc1O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.65
GABRA1 P14867 1/20 0.54
GABRB2 P47870 1/20 0.54
LMNA P02545 2/20 0.52
POLB P06746 2/20 0.43
ADRB1 P08588 1/20 0.42
ADRA2A P08913 1/20 0.42
ADRB3 P13945 1/20 0.42
ADRA2B P18089 1/20 0.42
ADRA2C P18825 1/20 0.42
KDM4E B2RXH2 1/20 0.39
NPC1 O15118 1/20 0.39
CA12 O43570 1/20 0.39
GMNN O75496 1/20 0.39
ALDH1A1 P00352 1/20 0.39
EGFR P00533 1/20 0.39
CA2 P00918 1/20 0.39
FYN P06241 1/20 0.39
CA3 P07451 1/20 0.39
CYP3A4 P08684 1/20 0.39

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
SCHEMBL30295406 1.00 TSHR (0.65) TSHRGABRA1GABRB2LMNAPOLB
SCHEMBL12610425 1.00 TSHR (0.65) TSHRGABRA1GABRB2LMNAPOLB
SCHEMBL9757096 0.90 TSHR (0.55) TSHRGABRA1GABRB2LMNAPOLB
Cadaverine Tartrate SCHEMBL1649361 0.87 TSHR (0.52) TSHRGABRA1GABRB2LMNAPOLB
SCHEMBL30172716 0.85 LMNA (0.61) TSHRGABRA1GABRB2LMNAADRB1
SCHEMBL5107136 0.85 LMNA (0.61) TSHRGABRA1GABRB2LMNAADRB1
SCHEMBL5107130 0.85 LMNA (0.61) TSHRGABRA1GABRB2LMNAADRB1
SCHEMBL5107133 0.85 LMNA (0.61) TSHRGABRA1GABRB2LMNAADRB1
SCHEMBL4738271 0.83 TSHR (0.55) TSHRGABRA1GABRB2LMNAPOLB
SCHEMBL2989016 0.83 TSHR (0.55) TSHRGABRA1GABRB2LMNAADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117836262-A Separation of dialkylene phenol glycol ethers 陶氏环球技术有限责任公司 2024-04-05 CN claimed
CN-112336660-A Eye cream for relieving asthenopia and preparation method thereof 四川福怡长者文化传播有限公司 2021-02-09 CN claimed
CN-109988213-A A kind of compound and its preparation method and application for peptide synthesis in liquid phase carrier 深圳翰宇药业股份有限公司 2019-07-09 CN claimed
CN-109988062-A A kind of liquid phase ball type carrier and its preparation method and application 深圳翰宇药业股份有限公司 2019-07-09 CN claimed
EP-0446865-B1 Gelation of acrylamide-containing polymers with hydroxyphenyl alkanols PHILLIPS PETROLEUM CO (US) 1994-09-21 EP claimed
US-5100931-A Crosslinking; enhanced oil recovery PHILLIPS PETROLEUM COMPANY (US) 1992-03-31 US claimed
EP-0446865-A2 Gelation of acrylamide-containing polymers with hydroxyphenyl alkanols PHILLIPS PETROLEUM COMPANY (US) 1991-09-18 EP claimed
JP-6321747-A None JP disclosed
US-20250161259-A1 TREATMENT OF CIRCADIAN RHYTHM DISORDERS VANDA PHARMACEUTICALS INC. 2025-05-22 US disclosed
EP-4502609-A2 DETERMINING A CIRCADIAN RHYTHM Vanda Pharmaceuticals Inc. (US) 2025-02-05 EP disclosed
US-12201604-B2 Treatment of circadian rhythm disorders VANDA PHARMACEUTICALS INC. (US) 2025-01-21 US disclosed
US-20240350451-A1 TREATMENT OF CIRCADIAN RHYTHM DISORDERS VANDA PHARMACEUTICALS INC. 2024-10-24 US disclosed
US-20240293355-A1 METHOD OF TREATMENT VANDA PHARMACEUTICALS INC. 2024-09-05 US disclosed
US-4920132-A Quinoline derivatives and use thereof as antagonists of leukotriene D4 RORER PHARMACEUTICAL CORP. (US) 1990-04-24 US disclosed
US-4920131-A Quinoline derivatives and use thereof as antagonists of leukotriene D4 RORER PHARMACEUTICAL CORP. (US) 1990-04-24 US disclosed
WO-1989012628-A1 QUINOLINE DERIVATIVES AS ANTAGONISTS OF LEUKOTRIENE D4 RORER INTERNATIONAL (OVERSEAS) INC. (US) 1989-12-28 WO disclosed
EP-0348155-A1 Quinoline derivatives as antagonists of leukotriene D4, compositions containing the same and processes for their preparation RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1989-12-27 EP disclosed
WO-1989004305-A1 QUINOLINE DERIVATIVES AS ANTAGONISTS OF LEUKOTRIENE D4 RORER INTERNATIONAL (OVERSEAS) INC. (US) 1989-05-18 WO disclosed
US-4029713-A ANTIOXIDANTS THE GOODYEAR TIRE & RUBBER COMPANY (US) 1977-06-14 US disclosed
US-3957883-A PROCESS FOR OXIDIZING ORGANIC COMPOUNDS TO PEROXIDES ATLANTIC RESEARCH CORPORATION (US) 1976-05-18 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 (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-12201604-B2 Treatment of circadian rhythm disorders CRY1, PER2, CRY2 TSHR 646/4885GABRA1 877/4885GABRB2 698/4885
US-20250161259-A1 TREATMENT OF CIRCADIAN RHYTHM DISORDERS CRY1, PER2, CRY2 TSHR 646/4885GABRA1 877/4885GABRB2 698/4885
US-20240293355-A1 METHOD OF TREATMENT METTL3, MTNR1B, HCRTR2 TSHR 1579/4885GABRA1 2312/4885GABRB2 1866/4885
US-20240350451-A1 TREATMENT OF CIRCADIAN RHYTHM DISORDERS CRY1, PER2, CRY2 TSHR 642/4885GABRA1 882/4885GABRB2 712/4885

“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.