SCHEMBL7114262

SCHEMBL7114262

OCCNCC1CCCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 1/20 0.44
ADH1C P00326 1/20 0.44
ADH1A P07327 1/20 0.44
ADH4 P08319 1/20 0.44
ADH7 P40394 1/20 0.44
SAT1 P21673 1/20 0.41
EPHX1 P07099 3/20 0.40
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC10 Q969S8 1/20 0.39
HDAC11 Q96DB2 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
HDAC9 Q9UKV0 1/20 0.39
HDAC5 Q9UQL6 1/20 0.39
ALDH1A1 P00352 1/20 0.38
TSHR P16473 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
SCHEMBL7121343 0.97 ADH1B (0.48) ADH1BADH1CADH1AADH4ADH7
SCHEMBL1761279 0.97 ADH1B (0.48) ADH1BADH1CADH1AADH4ADH7
SCHEMBL19401272 0.97 ADH1B (0.48) ADH1BADH1CADH1AADH4ADH7
SCHEMBL18994769 0.97 ADH1B (0.48) ADH1BADH1CADH1AADH4ADH7
SCHEMBL7118925 0.97 ADH1B (0.48) ADH1BADH1CADH1AADH4ADH7
SCHEMBL18994695 0.97 ADH1B (0.48) ADH1BADH1CADH1AADH4ADH7
SCHEMBL22299782 0.97 ADH1B (0.48) ADH1BADH1CADH1AADH4ADH7
Hydrochloric Acid SCHEMBL4346255 0.95 ADH1B (0.46) ADH1BADH1CADH1AADH4ADH7
SCHEMBL3429766 0.95
SCHEMBL3429214 0.89

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113620906-A Method for preparing ethylenediamine and ethanolamine derivatives by photocatalysis of biomass polyols 中国科学院大连化学物理研究所 2021-11-09 CN claimed
US-11006829-B1 System and method for wireless communication of glucose data DEXCOM, INC. (US) 2021-05-18 US disclosed
US-20210137380-A1 SYSTEM AND METHOD FOR WIRELESS COMMUNICATION OF GLUCOSE DATA DEXCOM, INC. 2021-05-13 US disclosed
US-20200345232-A1 SYSTEM AND METHOD FOR WIRELESS COMMUNICATION OF GLUCOSE DATA DEXCOM, INC. 2020-11-05 US disclosed
US-20030207865-A1 Substituted 2-arylimino heterocycles and compositions containing them for use as progesterone receptor binding agents DIXON BRIAN R (US) 2003-11-06 US disclosed
US-6353006-B1 TREATMENT OF BONE DISORDERS, OSTEOPOROSIS AND HEALING AGENT BAYER CORPORATION 2002-03-05 US disclosed
EP-1144396-A2 SUBSTITUTED 2-ARYLIMINO HETEROCYCLES AND COMPOSITIONS CONTAINING THEM, FOR USE AS PROGESTERONE RECEPTOR BINDING AGENTS Bayer Corporation (US) 2001-10-17 EP disclosed
WO-2000042031-A2 SUBSTITUTED 2-ARYLIMINO HETEROCYCLES AND COMPOSITIONS CONTAINING THEM, FOR USE AS PROGESTERONE RECEPTOR BINDING AGENTS BAYER CORPORATION (US) 2000-07-20 WO 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-20030207865-A1 Substituted 2-arylimino heterocycles and compositions containing them for use as progesterone receptor binding agents PGR, PGRMC2, PGRMC1 ADH1B 1846/4885ADH1C 1039/4885ADH1A 1021/4885

“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.