SCHEMBL2431512

SCHEMBL2431512

Cc1c(C(N)=O)cccc1C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.52
▸ ALDH1A1 P00352 5/20 0.50
▸ KDM4E B2RXH2 5/20 0.50
▸ HSD17B10 Q99714 4/20 0.50
▸ HPGD P15428 4/20 0.50
▸ MYC P01106 2/20 0.50
▸ ALOX15 P16050 1/20 0.48
▸ NPC1 O15118 1/20 0.47
▸ CASP3 P42574 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ SENP8 Q96LD8 1/20 0.47
▸ SENP7 Q9BQF6 1/20 0.47
▸ SENP6 Q9GZR1 1/20 0.47
▸ PARP1 P09874 2/20 0.46
▸ G6PD P11413 1/20 0.45
▸ CASP7 P55210 1/20 0.45
▸ CASP6 P55212 1/20 0.45
▸ MMP2 P08253 1/20 0.45
▸ BCAT2 O15382 1/20 0.45
▸ MAPT P10636 1/20 0.45

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
SCHEMBL39964 0.91 KDM4E (0.52) TSHRALDH1A1KDM4EHSD17B10HPGD
SCHEMBL27533414 0.89 TSHR (0.53) TSHRALDH1A1KDM4EHSD17B10HPGD
Hydrazine SCHEMBL28166056 0.89 TSHR (0.57) TSHRALDH1A1KDM4EHSD17B10HPGD
Hydrochloric Acid SCHEMBL4562961 0.89 PARP1 (0.50) TSHRALDH1A1KDM4EHSD17B10HPGD
SCHEMBL756585 0.89 TSHR (0.61) TSHRALDH1A1KDM4EHSD17B10HPGD
SCHEMBL27703149 0.89 TSHR (0.61) TSHRALDH1A1KDM4EHSD17B10HPGD
Benzene SCHEMBL27265959 0.89 TSHR (0.61) TSHRALDH1A1KDM4EHSD17B10HPGD
Guanidine SCHEMBL27394274 0.87 TSHR (0.52) TSHRALDH1A1KDM4EHSD17B10HPGD
SCHEMBL29625222 0.86 CYP1A2 (0.46) TSHRALDH1A1KDM4EHSD17B10HPGD
SCHEMBL10768142 0.86 TSHR (0.59) TSHRALDH1A1KDM4EHSD17B10HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117980323-A Recombinant variants of R-spondin proteins and uses thereof 迪奥根克斯公司 2024-05-03 — — CN disclosed
EP-3896521-B1 POLYMER, PHOTOSENSITIVE RESIN COMPOSITION, PATTERNING METHOD, METHOD OF FORMING CURED FILM, INTERLAYER INSULATING FILM, SURFACE PROTECTIVE FILM, AND ELECTRONIC COMPONENT SHINETSU CHEMICAL CO (JP) 2022-12-14 — — EP disclosed
US-11333975-B2 Polymer, photosensitive resin composition, patterning method, method of forming cured film, interlayer insulating film, surface protective film, and electronic component INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2022-05-17 — — US disclosed
EP-3896521-A1 POLYMER, PHOTOSENSITIVE RESIN COMPOSITION, PATTERNING METHOD, METHOD OF FORMING CURED FILM, INTERLAYER INSULATING FILM, SURFACE PROTECTIVE FILM, AND ELECTRONIC COMPONENT Shin-Etsu Chemical Co., Ltd. (JP) 2021-10-20 — — EP disclosed
US-20210317268-A1 POLYMER, PHOTOSENSITIVE RESIN COMPOSITION, PATTERNING METHOD, METHOD OF FORMING CURED FILM, INTERLAYER INSULATING FILM, SURFACE PROTECTIVE FILM, AND ELECTRONIC COMPONENT SHIN-ETSU CHEMICAL CO., LTD. (JP) 2021-10-14 — — US disclosed
CN-103371981-A Compound repaglinide-metformin hydrochloride solid quick-release preparation and preparation method and application thereof TIANJIN INST PHARM RESEARCH 2013-10-30 — — CN disclosed
US-8012956-B2 Tropane compounds EXELIXIS, INC. (US) 2011-09-06 — — US disclosed
US-8012956-B2 Tropane compounds EXELIXIS, INC. (US) 2011-09-06 — — US disclosed
EP-2074120-B1 TROPANE COMPOUNDS EXELIXIS INC (US) 2010-03-03 — — EP disclosed
EP-2074120-A1 TROPANE COMPOUNDS Exelixis, Inc. (US) 2009-07-01 — — EP disclosed
US-20090163471-A1 Tropane compounds EXELIXIS, INC. 2009-06-25 — — US disclosed
US-20090163471-A1 Tropane compounds EXELIXIS, INC. 2009-06-25 — — US disclosed
WO-2009055077-A1 TROPANE COMPOUNDS EXELIXIS, INC. (US) 2009-04-30 — — WO disclosed
EP-1935424-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING COMBINED ANTIDIABETIC SUBSTANCES FOR USE IN DIABETES MELLITUS ESPINOZA ABDALA, Leopoldo de Jesús (MX) 2008-06-25 — — EP disclosed
CN-1215040-C Synthetic method of 4-acetoxy-2-ethoxy ethyl benzoate SHANGHAI SUNVE PHARMACEUTICAL (CN) 2005-08-17 — — CN disclosed
CN-1500772-A Synthetic method of 4-acetoxy-2-ethoxy ethyl benzoate 上海三维制药有限公司 2004-06-02 — — CN 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-20090163471-A1 Tropane compounds ADRA1B, ADRA2B, ADRB2 TSHR 172/4885ALDH1A1 323/4885KDM4E 4402/4885

“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.

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