SCHEMBL1729138

SCHEMBL1729138

CN(C)CCCCCCCCCCCCCCN(C)C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 1.00
TSHR P16473 1/20 1.00
DNM1 Q05193 3/20 0.73
SIGMAR1 Q99720 2/20 0.48
TDP1 Q9NUW8 2/20 0.47
CA12 O43570 1/20 0.47
CA2 P00918 1/20 0.47
CA3 P07451 1/20 0.47
CA4 P22748 1/20 0.47
CA6 P23280 1/20 0.47
CA5A P35218 1/20 0.47
CA7 P43166 1/20 0.47
CA9 Q16790 1/20 0.47
CA14 Q9ULX7 1/20 0.47
CA5B Q9Y2D0 1/20 0.47
MAPT P10636 1/20 0.44
CHRM2 P08172 1/20 0.42
HSD17B10 Q99714 1/20 0.42
KDM4A O75164 4/20 0.41
KDM4C Q9H3R0 4/20 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
SCHEMBL13169236 1.00 ALDH1A1 (1.00) ALDH1A1TSHRDNM1SIGMAR1TDP1
SCHEMBL8083779 1.00 ALDH1A1 (1.00) ALDH1A1TSHRDNM1SIGMAR1TDP1
SCHEMBL231640 1.00 ALDH1A1 (1.00) ALDH1A1TSHRDNM1SIGMAR1TDP1
SCHEMBL1892890 1.00 ALDH1A1 (1.00) ALDH1A1TSHRDNM1SIGMAR1TDP1
SCHEMBL7942101 1.00 ALDH1A1 (1.00) ALDH1A1TSHRDNM1SIGMAR1TDP1
SCHEMBL235238 1.00 ALDH1A1 (1.00) ALDH1A1TSHRDNM1SIGMAR1TDP1
SCHEMBL8087077 1.00 ALDH1A1 (1.00) ALDH1A1TSHRDNM1SIGMAR1TDP1
SCHEMBL8083762 1.00 ALDH1A1 (1.00) ALDH1A1TSHRDNM1SIGMAR1TDP1
SCHEMBL35856 1.00 ALDH1A1 (1.00) ALDH1A1TSHRDNM1SIGMAR1TDP1
SCHEMBL1730287 1.00 ALDH1A1 (1.00) ALDH1A1TSHRDNM1SIGMAR1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1934234-B1 NOVEL AMINE-BORANE COMPOUNDS AND USES THEREOF YISSUM RES DEV CO (IL) 2011-11-30 EP claimed
US-20250019836-A1 TREATMENT LIQUID, TREATMENT METHOD, AND METHOD FOR MANUFACTURING ELECTRONIC DEVICE FUJIFILM CORPORATION (JP) 2025-01-16 US disclosed
WO-2023189353-A1 TREATMENT LIQUID, TREATMENT METHOD, AND METHOD FOR MANUFACTURING ELECTRONIC DEVICE 富士フイルム株式会社 2023-10-05 WO disclosed
US-20100284914-A1 Novel Amine-Borane Compounds and Uses Thereof YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL) 2010-11-11 US disclosed
US-20090131366-A1 Use of Amine-Borane Compounds as Anti-Microbial Agents HADASIT MEDICAL RESEARCH SERVICES AND DEVELOPMENT LTD. (IL) 2009-05-21 US disclosed
EP-0519406-B1 Magnetic recording media using perfluoropolyether derivatives as lubricants SONY CORP (JP) 2000-10-25 EP disclosed
US-5536425-A DURABILITY SONY CORPORATION (JP) 1996-07-16 US disclosed
US-5453539-A Durability SONY CORPORATION (JP) 1995-09-26 US disclosed
EP-0519406-A2 Novel perfluoropolyether derivatives, and lubricants and magnetic recording medium using the same SONY CORPORATION (JP) 1992-12-23 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-20090131366-A1 Use of Amine-Borane Compounds as Anti-Microbial Agents BCAT2, BCAT1, ARG1 ALDH1A1 3639/4885TSHR 2627/4885DNM1 2204/4885
US-20100284914-A1 Novel Amine-Borane Compounds and Uses Thereof SLC1A5, BDKRB1, PAICS ALDH1A1 3757/4885TSHR 1109/4885DNM1 2564/4885

“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.