SCHEMBL20817522

SCHEMBL20817522

Cc1nccn1-c1cccc(OCC(C)O)c1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ICMT O60725 3/20 0.55
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
LMNA P02545 1/20 0.47
CYP3A4 P08684 2/20 0.47
CYP2E1 P05181 1/20 0.47
CYP2A6 P11509 1/20 0.47
CYP1A2 P05177 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP19A1 P11511 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
GRM5 P41594 1/20 0.44
ADRB1 P08588 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
SCHEMBL30797922 1.00 ICMT (0.55) ICMTMEN1KMT2ALMNACYP3A4
SCHEMBL20817526 0.81 ICMT (0.59) ICMTMEN1KMT2ALMNA
SCHEMBL30798095 0.81 ICMT (0.59) ICMTMEN1KMT2ALMNA
SCHEMBL20817569 0.81 ICMT (0.59) ICMTMEN1KMT2ALMNA
SCHEMBL20817524 0.81 ICMT (0.59) ICMTMEN1KMT2ALMNA
SCHEMBL30797739 0.81 ICMT (0.59) ICMTMEN1KMT2ALMNA
SCHEMBL20817610 0.81 ICMT (0.47) ICMTMEN1KMT2ACYP3A4CYP2E1
SCHEMBL30797906 0.81 ICMT (0.47) ICMTMEN1KMT2ACYP3A4CYP2E1
SCHEMBL20817527 0.80 CYP3A4 (0.51) ICMTMEN1KMT2ACYP3A4CYP2E1
SCHEMBL20817556 0.80 ICMT (0.52) ICMTMEN1KMT2ALMNACYP3A4

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
CN-111344284-B Compounds useful as inhibitors of isoprene cysteine carboxymethyltransferase 新加坡科技研究局 2024-03-12 CN disclosed
US-11834430-B2 Compounds useful as inhibitors of isoprenylcysteine carboxyl methyltransferase AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2023-12-05 US disclosed
US-11834430-B2 Compounds useful as inhibitors of isoprenylcysteine carboxyl methyltransferase AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2023-12-05 US disclosed
US-11834430-B2 Compounds useful as inhibitors of isoprenylcysteine carboxyl methyltransferase AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2023-12-05 US disclosed
US-20210130317-A1 Compounds Useful as Inhibitors of Isoprenylcysteine Carboxyl Methyltransferase AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2021-05-06 US disclosed
US-20210130317-A1 Compounds Useful as Inhibitors of Isoprenylcysteine Carboxyl Methyltransferase AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2021-05-06 US disclosed
EP-3681878-A1 COMPOUNDS USEFUL AS INHIBITORS OF ISOPRENYLCYSTEINE CARBOXYL METHYLTRANSFERASE Agency for Science, Technology and Research (SG) 2020-07-22 EP disclosed
CN-111344284-A Compounds useful as inhibitors of isoprene cysteine carboxymethyltransferase 新加坡科技研究局 2020-06-26 CN disclosed
WO-2019054944-A1 COMPOUNDS USEFUL AS INHIBITORS OF ISOPRENYLCYSTEINE CARBOXYL METHYLTRANSFERASE AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2019-03-21 WO disclosed
WO-2019054944-A1 COMPOUNDS USEFUL AS INHIBITORS OF ISOPRENYLCYSTEINE CARBOXYL METHYLTRANSFERASE AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2019-03-21 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 (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-20210130317-A1 Compounds Useful as Inhibitors of Isoprenylcysteine Carboxyl Methyltransferase ICMT, INMT, BHMT ICMT 1/4885MEN1 200/4885KMT2A 737/4885
US-11834430-B2 Compounds useful as inhibitors of isoprenylcysteine carboxyl methyltransferase ICMT, INMT, BHMT ICMT 1/4885MEN1 200/4885KMT2A 737/4885

“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.