SCHEMBL7182358

SCHEMBL7182358

CCCOc1ccc(PC(=O)c2c(OC)cc(OC)cc2OC)c(C)c1.[LiH]

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.41
CYP1A1 P04798 1/20 0.39
CYP1B1 Q16678 1/20 0.39
ACACB O00763 3/20 0.38
CYP3A4 P08684 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
USP2 O75604 1/20 0.38
MAPK1 P28482 1/20 0.38
SLC5A1 P13866 1/20 0.38
SLC5A2 P31639 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
THRA P10827 1/20 0.37
THRB P10828 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
ERN1 O75460 1/20 0.37
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL7175230 0.95 THRA (0.42) KMT2ACYP3A4SMN1; SMN2USP2MAPK1
SCHEMBL7180616 0.93 THRA (0.45) KMT2ATHRATHRB
SCHEMBL7175053 0.92 THRA (0.47) THRATHRBTSHR
SCHEMBL7181520 0.91 KMT2A (0.41) KMT2ASMN1; SMN2MAPK1L3MBTL1ERN1
SCHEMBL7186863 0.91 KMT2A (0.41) KMT2ACYP3A4SMN1; SMN2USP2MAPK1
SCHEMBL7180950 0.91 KMT2A (0.42) KMT2ACYP3A4SMN1; SMN2USP2MAPK1
SCHEMBL7181350 0.91 KMT2A (0.42) KMT2ACYP1A1CYP1B1ACACBCYP3A4
SCHEMBL7189974 0.90 KMT2A (0.39) KMT2ACYP3A4SMN1; SMN2USP2MAPK1
Lithium SCHEMBL7181363 0.88 KMT2A (0.42) KMT2ACYP1A1CYP1B1ACACBCYP3A4
SCHEMBL7183202 0.88 MAPK1 (0.40) KMT2AACACBCYP3A4SMN1; SMN2USP2

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-6579663-B2 Chemical intermediates such as lithium 2,6-dimethylbenzoyl phenylphosphine for preparation of acylphosphines, acylphosphine oxides or acylphosphine sulfides CIBA SPECIALTY CHEMICALS CORPORATION 2003-06-17 US disclosed
US-20020107413-A1 Organometallic monoacylarylphosphines WOLF JEAN-PIERRE (CH) 2002-08-08 US disclosed
US-6399805-B2 SUCH AS LITHIUM 2,6-DIMETHYLBENZOYLPHENYLPHOSPHINE, USE AS PHOTOINITIATORS IN PHOTOCURABLE COMPOSITIONS SUCH AS FOR PHOTOGRAPHIC PRODUCTION OF RELIEF IMAGES CIBA SPECIALTY CHEMICALS CORPORATION 2002-06-04 US disclosed
US-20010031898-A1 Organometallic monoacylarylphosphines CIBA SPECIALTY CHEMICALS CORP. 2001-10-18 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 (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-20020107413-A1 Organometallic monoacylarylphosphines CBR1, NAF1, DHCR24 KMT2A 1586/4885CYP1A1 793/4885CYP1B1 885/4885
US-20010031898-A1 Organometallic monoacylarylphosphines NAF1, DHCR24, CBR1 KMT2A 956/4885CYP1A1 1252/4885CYP1B1 1489/4885

“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.