SCHEMBL3780468

SCHEMBL3780468

CCCCCCCC[P+](CC)(CC)CC.CS(=O)(=O)[O-]

nearest known ligand 0.52

Known targets — ChEMBL curated mechanism

ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.52
NR1I2 O75469 1/20 0.41
RECQL P46063 2/20 0.41
GLA P06280 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
EPHX2 P34913 1/20 0.41
BLM P54132 1/20 0.41
PPARA Q07869 2/20 0.38
GGPS1 O95749 2/20 0.37
FAAH O00519 2/20 0.37
TP53 P04637 1/20 0.36
CA2 P00918 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
SCHEMBL829599 0.91 DNM1 (0.64) DNM1NR1I2RECQLGLAHPGD
SCHEMBL7128039 0.91 DNM1 (0.64) DNM1NR1I2RECQLGLAHPGD
SCHEMBL3780740 0.89 DNM1 (0.68) DNM1NR1I2RECQLGLAHPGD
SCHEMBL832250 0.89 DNM1 (0.68) DNM1NR1I2RECQLGLAHPGD
SCHEMBL18604170 0.86 DNM1 (0.46) DNM1NR1I2RECQLGLAHPGD
Trifluoromethanesulfonic Acid SCHEMBL3782746 0.84 KCNH2 (0.45) DNM1NR1I2RECQLGLAHPGD
Trifluoromethanesulfonic Acid SCHEMBL3779474 0.84 KCNH2 (0.45) DNM1NR1I2RECQLGLAHPGD
SCHEMBL31125177 0.83 DNM1 (0.72) DNM1TSHR
SCHEMBL30616360 0.83 DNM1 (0.72) DNM1TSHR
SCHEMBL30698153 0.83 DNM1 (0.72) DNM1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8357822-B2 Process for producing high-purity chlorophosphite NIPPON CHEMICAL INDUSTRIAL CO., LTD. (JP) 2013-01-22 US disclosed
US-20100324337-A1 PROCESS FOR PRODUCING HIGH-PURITY CHLOROPHOSPHITE NIPPON CHEMICAL INDUSTRIAL CO., LTD. (JP) 2010-12-23 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-20100324337-A1 PROCESS FOR PRODUCING HIGH-PURITY CHLOROPHOSPHITE PHOSPHO1, RPP30, PCBP1 DNM1 3817/4885NR1I2 4678/4885RECQL 3564/4885

“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.