SCHEMBL7326104

SCHEMBL7326104

CCNCCCCC(C)O

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.52
CYP1A2 P05177 1/20 0.52
MEN1 O00255 1/20 0.48
GLA P06280 1/20 0.48
KMT2A Q03164 1/20 0.48
TSHR P16473 3/20 0.46
KDM1A O60341 5/20 0.43
SAT1 P21673 3/20 0.39
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.32
PKM P14618 1/20 0.32
TP53 P04637 1/20 0.32
HRH4 Q9H3N8 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
SPHK1 Q9NYA1 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
SCHEMBL9227994 0.98 CYP2C19 (0.50) CYP2C19CYP1A2MEN1GLAKMT2A
SCHEMBL5191406 0.98 CYP2C19 (0.50) CYP2C19CYP1A2MEN1GLAKMT2A
SCHEMBL25973248 0.93
SCHEMBL10874428 0.87 ALDH1A1 (0.41) CYP2C19CYP1A2MEN1GLAKMT2A
SCHEMBL19921563 0.84 TSHR (0.59) CYP2C19CYP1A2TSHRALDH1A1TP53
SCHEMBL27262286 0.84 TSHR (0.59) CYP2C19CYP1A2TSHRALDH1A1TP53
SCHEMBL19921564 0.84 PAOX (0.47) CYP2C19CYP1A2MEN1GLAKMT2A
SCHEMBL19293338 0.84 TSHR (0.52) CYP2C19CYP1A2TSHRALDH1A1TP53
SCHEMBL12707478 0.84 TSHR (0.52) CYP2C19CYP1A2TSHRALDH1A1TP53
SCHEMBL21357680 0.82

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11851390-B2 Reaction of glycoladehyde TAMINCO BVBA 2023-12-26 US disclosed
US-20210139410-A1 REACTION OF GLYCOLADEHYDE TAMINCO BVBA (BE) 2021-05-13 US disclosed
EP-3774717-A1 REACTION OF GLYCOLALDEHYDE TAMINCO BVBA (BE) 2021-02-17 EP disclosed
CN-111971269-A Reaction of glycolaldehyde 塔明克公司 2020-11-20 CN disclosed
EP-3290401-B1 N-SUBSTITUTED ACYCLIC ETHYLENE DIAMINES TAMINCO BVBA (BE) 2020-09-23 EP disclosed
WO-2019193117-A1 REACTION OF GLYCOLALDEHYDE KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2019-10-10 WO disclosed
EP-3290401-A1 N-SUBSTITUTED ACYCLIC ETHYLENE DIAMINES Taminco bvba (BE) 2018-03-07 EP disclosed
EP-0287696-B1 ISOQUINOLINE DERIVATIVES Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1991-01-02 EP disclosed
US-4798897-A (AMINOALKYL)AMINOSULFONYL-SUBSTITUTED CARDIOVASCULAR AND RESPIRATORY SYSTEM DISORDERS ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1989-01-17 US disclosed
EP-0287696-A1 Isoquinoline derivatives Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1988-10-26 EP 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 (2 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-11851390-B2 Reaction of glycoladehyde ADH1A, ADH1C, GRHPR CYP2C19 639/4885CYP1A2 341/4885MEN1 1424/4885
US-20210139410-A1 REACTION OF GLYCOLADEHYDE ADH1A, ADH1C, GRHPR CYP2C19 639/4885CYP1A2 341/4885MEN1 1424/4885

“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.