SCHEMBL11032152

SCHEMBL11032152

CCCCCC(N)(CCCCC)C(N)(CCCCC)CCCCC

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FDPS P14324 4/20 0.48
SMPD1 P17405 4/20 0.46
TSHR P16473 2/20 0.44
THRB P10828 1/20 0.44
DNM1 Q05193 6/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 1/20 0.40
EPHX1 P07099 1/20 0.40
GGPS1 O95749 2/20 0.39

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
SCHEMBL28831313 0.97 SMPD1 (0.50) FDPSSMPD1TSHRTHRBDNM1
SCHEMBL31531222 0.97 FDPS (0.46) FDPSSMPD1TSHRTHRBDNM1
SCHEMBL1433957 0.97 SMPD1 (0.50) FDPSSMPD1TSHRTHRBDNM1
SCHEMBL323277 0.90 FDPS (0.46) FDPSSMPD1TSHRTHRBDNM1
SCHEMBL9173391 0.84 LMNA (0.48) FDPSSMPD1TSHRMEN1KMT2A
SCHEMBL6790923 0.84 FDPS (0.42) FDPSSMPD1TSHRTHRBDNM1
SCHEMBL16936158 0.83 SMPD1 (0.45) FDPSSMPD1TSHRTHRBDNM1
SCHEMBL28894416 0.83 SMPD1 (0.45) FDPSSMPD1TSHRTHRBDNM1
SCHEMBL11131217 0.83 FDPS (0.41) FDPSSMPD1TSHRTHRBDNM1
SCHEMBL16936118 0.83 SMPD1 (0.45) FDPSSMPD1TSHRTHRBDNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113620906-B Method for preparing ethylenediamine and ethanolamine derivatives by photocatalytic biomass polyalcohol 中国科学院大连化学物理研究所 2023-05-19 CN claimed
CN-114984925-A Method for extracting uranium from seawater by utilizing gemini quaternary ammonium salt adsorbent 济南大学 2022-09-02 CN claimed
CN-113620906-A Method for preparing ethylenediamine and ethanolamine derivatives by photocatalysis of biomass polyols 中国科学院大连化学物理研究所 2021-11-09 CN claimed
US-4539007-A PEROXIDE AND ACTIVATOR, UREA, SURFACTANT, WEAK BASE, WATER HOECHST AKTIENGESELLSCHAFT (DE) 1985-09-03 US disclosed
US-4218559-A FUSED PYRAZINE COMPOUNDS AMERICAN CYANAMID COMPANY (US) 1980-08-19 US disclosed