SCHEMBL63306

SCHEMBL63306

SCCNCCNCCS

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.56
LMNA P02545 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
CA12 O43570 2/20 0.38
CA6 P23280 2/20 0.38
CA7 P43166 2/20 0.38
CA9 Q16790 2/20 0.38
CA14 Q9ULX7 2/20 0.38
CA5B Q9Y2D0 2/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA3 P07451 1/20 0.38
ALOX15 P16050 1/20 0.38
CA4 P22748 1/20 0.38
CA5A P35218 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TP53 P04637 1/20 0.38
KDM4E B2RXH2 1/20 0.35
CASP2 P42575 1/20 0.33
MEN1 O00255 1/20 0.31

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
SCHEMBL20985200 1.00 ESR1 (0.56) ESR1LMNATDP1CA12CA6
SCHEMBL38044 0.95
SCHEMBL8906125 0.86 ESR1 (0.60) ESR1LMNATDP1CA12CA6
SCHEMBL4983850 0.84 ESR1 (0.67) ESR1LMNATDP1CA12CA6
SCHEMBL12846992 0.83
SCHEMBL11228775 0.83 ESR1 (0.74) ESR1LMNATDP1CA12CA6
SCHEMBL7524242 0.83 ESR1 (0.74) ESR1LMNATDP1CA12CA6
SCHEMBL12427551 0.83
SCHEMBL4449112 0.81
SCHEMBL3360937 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12529013-B2 Injectivity improvement with thioalcohols BAKER HUGHES OILFIELD OPERATIONS LLC (US) 2026-01-20 US claimed
EP-4594443-A1 INJECTIVITY IMPROVEMENT WITH THIOALCOHOLS Baker Hughes Oilfield Operations LLC (US) 2025-08-06 EP claimed
WO-2024108008-A1 INJECTIVITY IMPROVEMENT WITH THIOALCOHOLS BAKER HUGHES OILFIELD OPERATIONS LLC (US) 2024-05-23 WO claimed
EP-4031642-A1 METAL REMOVAL FROM FLUIDS Baker Hughes Holdings LLC (US) 2022-07-27 EP claimed
US-11326109-B2 Metal removal from glycol fluids BAKER HUGHES HOLDINGS LLC (US) 2022-05-10 US claimed
US-20210246376-A1 METAL REMOVAL FROM GLYCOL FLUIDS BAKER HUGHES, A GE COMPANY, LLC (US) 2021-08-12 US claimed
WO-2021055135-A1 METAL REMOVAL FROM FLUIDS BAKER HUGHES, A GE COMPANY, LLC (US) 2021-03-25 WO claimed
US-20080138309-A1 Use Of Aminodithiol As A Reducing Agent For Hair Perming L'OREAL S.A. (FR) 2008-06-12 US claimed
US-20060189567-A1 Compound having affinity with calcified tissue NIHON MEDI-PHYSICS CO., LTD. (JP) 2006-08-24 US claimed
EP-1609797-A1 COMPOUND HAVING AFFINITY WITH CALCIFIED TISSUE Nihon Medi-Physics Co., Ltd. (JP) 2005-12-28 EP claimed
US-6660863-B2 Reacting an cycloheptatriene nitrile compound with nortropane compound NIHON MEDI-PHYSICS CO., LTD. (JP) 2003-12-09 US claimed
US-20030109708-A1 Process for synthesizing anhydroecgonine derivative NIHON MEDI-PHYSICS CO., LTD. 2003-06-12 US claimed
US-20010020096-A1 Process for synthesizing anhydroecgonine derivative NIHON MEDI-PHYSICS CO., LTD. (JP) 2001-09-06 US claimed
EP-1127887-A1 Process for synthesizing anhydroecgonine derivative NIHON MEDI-PHYSICS Co., Ltd. (JP) 2001-08-29 EP claimed
US-6127530-A Method for the reduction of oxygenated compounds of rhenium or technetium NYCOMED AMERSHAM SORIN S.R.L. (IT) 2000-10-03 US claimed
US-20260117145-A1 INJECTIVITY IMPROVEMENT WITH THIOALCOHOLS BAKER HUGHES OILFIELD OPERATIONS LLC (US) 2026-04-30 US disclosed
US-20260083865-A1 PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA) LIGANDS AND USE THEREOF 3B PHARMACEUTICALS GMBH (DE) 2026-03-26 US disclosed
EP-0279417-A2 Ester-substituted diaminedithiols and radiolabeled complexes thereof THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1988-08-24 EP disclosed
US-4272632-A BIS-MERCAPTOALKYL-ETHYLENE(PROPYENE-)DIAMINE POLAROID CORPORATION (US) 1981-06-09 US disclosed
US-4251617-A THIO-POLYAMINES, DIFFUSION TRANSFER PHOTOGRAPHY POLAROID CORPORATION (US) 1981-02-17 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 (7 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-20260083865-A1 PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA) LIGANDS AND USE THEREOF KLK3, FOLH1, PSMA1 ESR1 1300/4885LMNA 1421/4885TDP1 3533/4885
US-20080138309-A1 Use Of Aminodithiol As A Reducing Agent For Hair Perming AASDHPPT, BHMT2, ALAD ESR1 4869/4885LMNA 2070/4885TDP1 1377/4885
US-20260117145-A1 INJECTIVITY IMPROVEMENT WITH THIOALCOHOLS GLO1, SORD, ALAD ESR1 3476/4885LMNA 4793/4885TDP1 2854/4885
US-20060189567-A1 Compound having affinity with calcified tissue SLC7A1, MBNL1, SHBG ESR1 1605/4885LMNA 1384/4885TDP1 4878/4885
US-20030109708-A1 Process for synthesizing anhydroecgonine derivative CES2, NPR1, OPRL1 ESR1 2793/4885LMNA 3660/4885TDP1 2245/4885
US-12529013-B2 Injectivity improvement with thioalcohols GLO1, PIGS, OGA ESR1 3189/4885LMNA 4599/4885TDP1 3020/4885
US-20010020096-A1 Process for synthesizing anhydroecgonine derivative CES2, NPR1, OPRL1 ESR1 2793/4885LMNA 3660/4885TDP1 2245/4885

“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.