SCHEMBL9807746

SCHEMBL9807746

CCCCCCCCCCCN(CC(C)C)CC(C)C

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 5/20 0.52
PLA2G1B P04054 1/20 0.43
PLA2G2A P14555 1/20 0.43
TSHR P16473 2/20 0.40
THRB P10828 1/20 0.40
GGPS1 O95749 3/20 0.38
KCNH2 Q12809 4/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
CYP1A2 P05177 1/20 0.36
MAPK1 P28482 1/20 0.36
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL9807760 1.00 DNM1 (0.52) DNM1PLA2G1BPLA2G2ATSHRTHRB
SCHEMBL9807723 1.00 DNM1 (0.52) DNM1PLA2G1BPLA2G2ATSHRTHRB
SCHEMBL9807789 1.00 DNM1 (0.52) DNM1PLA2G1BPLA2G2ATSHRTHRB
SCHEMBL10712630 1.00 DNM1 (0.52) DNM1PLA2G1BPLA2G2ATSHRTHRB
SCHEMBL9807743 1.00 DNM1 (0.52) DNM1PLA2G1BPLA2G2ATSHRTHRB
SCHEMBL19333372 1.00 DNM1 (0.52) DNM1PLA2G1BPLA2G2ATSHRTHRB
SCHEMBL17526607 1.00 DNM1 (0.52) DNM1PLA2G1BPLA2G2ATSHRTHRB
Hydrochloric Acid SCHEMBL11413603 0.98 DNM1 (0.54) DNM1PLA2G1BPLA2G2ATSHRTHRB
SCHEMBL4997677 0.97 DNM1 (0.48) DNM1PLA2G1BPLA2G2ATSHRTHRB
SCHEMBL10712988 0.95 DNM1 (0.52) DNM1PLA2G1BPLA2G2ATSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160039879-A1 NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF S&T GLOBAL INC. (US) 2016-02-11 US disclosed
EP-0323163-B1 SHIFT-FEEL DURABILITY ENHANCEMENT ETHYL PETROLEUM ADDITIVES, INC. (US) 1991-05-29 EP disclosed
EP-0323163-A1 Shift-feel Durability enhancement ETHYL PETROLEUM ADDITIVES, INC. (US) 1989-07-05 EP disclosed
US-4795583-A FRICTION MODIFIER FOR AUTOMATIC TRANSMISSION FLUIDS CONTAINING AN ALIPHATIC TERTIARY AMINE, ALIPHATIC DIAMINE AND-OR N-SUBSTITUTED DIALKANOLAMINE ETHYL PETROLEUM ADDITIVES, INC. (US) 1989-01-03 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 (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-20160039879-A1 NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF FKBP1B, MALT1, FKBP5 DNM1 3016/4885PLA2G1B 4667/4885PLA2G2A 4836/4885

“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.