SCHEMBL2780243

SCHEMBL2780243

O=C(O)c1[c]cc(C(=O)O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.50
TP53 P04637 1/20 0.50
SRD5A2 P31213 4/20 0.44
CA1 P00915 3/20 0.42
CA2 P00918 3/20 0.42
CA12 O43570 2/20 0.42
CA4 P22748 2/20 0.42
CA6 P23280 2/20 0.42
CA7 P43166 2/20 0.42
CA9 Q16790 2/20 0.42
CA14 Q9ULX7 2/20 0.42
CA3 P07451 1/20 0.42
TYR P14679 1/20 0.42
DRD1 P21728 1/20 0.42
CA5A P35218 1/20 0.42
CA5B Q9Y2D0 1/20 0.42
ALDH1A1 P00352 2/20 0.41
ALOX15 P16050 1/20 0.41
TPMT P51580 1/20 0.41
SMN1; SMN2 Q16637 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
SCHEMBL4957915 0.98 TSHR (0.48) TSHRTP53SRD5A2CA1CA2
SCHEMBL578580 0.78 TSHR (0.52) TSHRTP53SRD5A2CA1CA2
SCHEMBL2441945 0.76 CA2 (0.42) TSHRTP53SRD5A2CA1CA2
SCHEMBL3906107 0.76 POLB (0.57) SRD5A2ALDH1A1KDM4EPOLBL3MBTL1
SCHEMBL185207 0.74 TSHR (0.48) TSHRTP53SRD5A2CA1CA2
SCHEMBL6631569 0.74 TSHR (0.48) TSHRTP53SRD5A2CA1CA2
SCHEMBL1869090 0.74 ALDH1A1 (0.50) TSHRTP53SRD5A2CA1CA2
SCHEMBL4030667 0.74 TPMT (0.44) TSHRTP53CA1CA2ALOX15
SCHEMBL16267153 0.74 ALDH1A1 (0.44) SRD5A2ALDH1A1TPMTSMN1; SMN2CES2
SCHEMBL3340202 0.74 BCL2L1 (0.40) TSHRCA1CA2ALDH1A1CES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116903869-A Zr-UiO-66-BA material, preparation method, application and saccharomyces cerevisiae concentration detection method 贵州茅台酒股份有限公司 2023-10-20 CN claimed
CN-114618441-B Controllable preparation method of MIL material and application of MIL material in separation and enrichment of polyalcohol 中国科学院大连化学物理研究所 2023-07-04 CN claimed
US-20220153713-A1 HYDRAZONE AMIDE DERIVATIVE AND APPLICATION THEREOF IN PREPARATION OF MEDICAMENTS FOR PREVENTING AND TREATING ALOPECIA SHENZHEN CELL INSPIRE PHARMACEUTICAL DEVELOPMENT CO., LTD. (CN) 2022-05-19 US claimed
US-20220153688-A1 HYDRAZONE AMIDE DERIVATIVES AND USE THEREOF IN PREPARATION OF ANTI-OSTEOPOROSIS DRUGS SHENZHEN CELL INSPIRE PHARMACEUTICAL DEVELOPMENT CO., LTD. (CN) 2022-05-19 US claimed
EP-3992184-A1 HYDRAZONE AMIDE DERIVATIVES AND USE THEREOF IN PREPARATION OF ANTI-OSTEOPOROSIS DRUGS Shenzhen Cell Inspire Pharmaceutical Development Co., Ltd. (CN) 2022-05-04 EP claimed
EP-3992185-A1 HYDRAZONE AMIDE DERIVATIVE AND APPLICATION THEREOF IN PREPARATION OF MEDICAMENTS FOR PREVENTING AND TREATING ALOPECIA Shenzhen Cell Inspire Pharmaceutical Development Co., Ltd. (CN) 2022-05-04 EP claimed
CN-113105411-A Hydrazone amide derivatives and pharmaceutical compositions 深圳市三启药物开发有限公司 2021-07-13 CN claimed
US-8975259-B2 Compositions and methods for inhibiting G protein signaling UNIVERSITY OF ROCHESTER (US) 2015-03-10 US claimed
US-20100130505-A1 COMPOSITIONS AND METHODS FOR INHIBITING G PROTEIN SIGNALING UNIVERSITY OF ROCHESTER (US) 2010-05-27 US claimed
CN-101687984-A Solid state polymerization process for polyester BASF SE 2010-03-31 CN claimed
US-7129264-B2 Biarylmethyl indolines and indoles as antithromboembolic agents BRISTOL-MYERS SQUIBB COMPANY (US) 2006-10-31 US claimed
EP-1633716-A2 BIARYLMETHYL INDOLINES, INDOLES AND TETRAHYDROQUINOLINES, USEFUL AS SERINE PROTEASE INHIBITORS Bristol-Myers Squibb Company (US) 2006-03-15 EP claimed
WO-2004094372-A2 COMPOUNDS USEFUL AS SERINE PROTEASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2004-11-04 WO claimed
US-20040220206-A1 Biarylmethyl indolines, indoles and tetrahydroquinolines, useful as serine protease inhibitors BRISTOL-MYERS SQUIBB COMPANY 2004-11-04 US claimed
CN-1127533-C Catalyst for producing polyester and process for producing polyester using the same TEIJIN LTD (JP) 2003-11-12 CN claimed
CN-1320135-A Catalyst for polyester production and process for process for producing polyester with the same TEIJIN LTD (JP) 2001-10-31 CN claimed
US-5879869-A HAVING LIGHT-INSENSITIVE HYDROPHILIC COLLOID LAYER EXHIBITING ANTIHALATION EFFECT FUJI PHOTO FILM CO., LTD (JP) 1999-03-09 US claimed
EP-0458442-B1 Colorants BASF AG (DE) 1997-08-20 EP claimed
EP-0476928-A1 Light-sensitive silver halide photographic material KONICA CORPORATION (JP) 1992-03-25 EP claimed
US-4774161-A LITHOGRAPHY, PRINTING PLATES FUJI PHOTO FILM CO., LTD. (JP) 1988-09-27 US claimed

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-20040220206-A1 Biarylmethyl indolines, indoles and tetrahydroquinolines, useful as serine protease inhibitors TFPI, TFPI2, F2 TSHR 2875/4885TP53 3506/4885SRD5A2 962/4885
US-20100130505-A1 COMPOSITIONS AND METHODS FOR INHIBITING G PROTEIN SIGNALING GNAI1, GNAI3, GNAI2 TSHR 2522/4885TP53 4171/4885SRD5A2 4321/4885
US-20220153688-A1 HYDRAZONE AMIDE DERIVATIVES AND USE THEREOF IN PREPARATION OF ANTI-OSTEOPOROSIS DRUGS SOST, HDAC5, PTH1R TSHR 1218/4885TP53 4852/4885SRD5A2 329/4885
US-20220153713-A1 HYDRAZONE AMIDE DERIVATIVE AND APPLICATION THEREOF IN PREPARATION OF MEDICAMENTS FOR PREVENTING AND TREATING ALOPECIA FH, HDGF, HRH4 TSHR 1288/4885TP53 3487/4885SRD5A2 130/4885

“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.