SCHEMBL2495182

SCHEMBL2495182

CC(C)=CCC/C(C)=C/CNC/C=C(\C)CCC=C(C)C

nearest known ligand 0.95

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.65
MEN1 O00255 2/20 0.60
CYP3A4 P08684 2/20 0.60
ALOX15 P16050 2/20 0.60
MAPT P10636 2/20 0.58
ALDH1A1 P00352 2/20 0.58
UGT1A1 P22309 1/20 0.58
SQLE Q14534 3/20 0.56
TRPA1 O75762 1/20 0.53
GGPS1 O95749 1/20 0.53
FDFT1 P37268 1/20 0.53
ABCG2 Q9UNQ0 1/20 0.53
KDM4E B2RXH2 1/20 0.52

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
SCHEMBL31406762 0.98 KMT2A (0.70) KMT2AMEN1CYP3A4ALOX15MAPT
SCHEMBL31406758 0.98 KMT2A (0.70) KMT2AMEN1CYP3A4ALOX15MAPT
SCHEMBL31406757 0.98 KMT2A (0.70) KMT2AMEN1CYP3A4ALOX15MAPT
SCHEMBL10445541 0.89 KMT2A (0.58) KMT2AMEN1CYP3A4ALOX15MAPT
SCHEMBL10445540 0.89 KMT2A (0.58) KMT2AMEN1CYP3A4ALOX15MAPT
SCHEMBL16892803 0.88 KMT2A (0.57) KMT2AMEN1CYP3A4ALOX15MAPT
SCHEMBL16892784 0.88 KMT2A (0.57) KMT2AMEN1CYP3A4ALOX15MAPT
SCHEMBL15516075 0.88 KMT2A (0.57) KMT2AMEN1CYP3A4ALOX15MAPT
SCHEMBL11645968 0.86 SQLE (0.57) KMT2AMEN1CYP3A4ALOX15MAPT
SCHEMBL11645972 0.86 SQLE (0.57) KMT2AMEN1CYP3A4ALOX15MAPT

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
JP-9291030-A None JP disclosed
JP-10218764-A None JP disclosed
JP-11130670-A None JP disclosed
JP-2011207802-A BIRTH RATE INCREASE PROMOTER APPLIED TO MAMMALS, TRANQUILIZER APPLIED TO MAMMALS, AND FEED FOR LIVESTOCK NAGASAKIKEN KORITSU DAIGAKU HOJIN 2011-10-20 JP disclosed
US-20090208458-A1 Transcriptional inhibitor for human k-ras gene NATIONAL UNIVERSITY CORPORATION HOKKAIDO UNIVERSITY (JP) 2009-08-20 US disclosed
US-6048882-A ISOPRENYLAMINE COMPOUND NISSHIN FLOUR MILLING CO., LTD. (JP) 2000-04-11 US disclosed
JP-H11130670-A OSTEOPOROSIS THERAPEUTIC AGENT OYO SEIKAGAKU KENKYUSHO 1999-05-18 JP disclosed
JP-H10218764-A PANCREATIC CANCER-TREATING AGENT TORAY IND INC 1998-08-18 JP disclosed
EP-0810201-A1 PREVENTIVE/REMEDY FOR LIVER DISEASE NISSHIN FLOUR MILLING CO., LTD. (JP) 1997-12-03 EP disclosed
JP-H09291030-A ANTICANCER DRUG CONTAINING GERANYLGERANYLAMINE DERIVATIVE AS ACTIVE INGREDIENT KURARAY CO LTD 1997-11-11 JP 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-20090208458-A1 Transcriptional inhibitor for human k-ras gene MYCBP, UPF1, MYC KMT2A 614/4885MEN1 1751/4885CYP3A4 4078/4885

“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.