SCHEMBL7180470

SCHEMBL7180470

Cc1cc(C(C)(C)C)cc(C)c1C(=O)Pc1ccc(OCCC(C)C)cc1.[LiH]

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.45
EPHX2 P34913 1/20 0.43
TP53 P04637 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
S1PR1 P21453 1/20 0.40
S1PR5 Q9H228 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
GAA P10253 1/20 0.39
HTT P42858 1/20 0.39
NR1H4 Q96RI1 1/20 0.37
ALDH1A1 P00352 1/20 0.37
THRB P10828 1/20 0.37
TSHR P16473 1/20 0.37
HSD17B10 Q99714 1/20 0.37
PDK2 Q15119 1/20 0.36
RARB P10826 1/20 0.36
MMP3 P08254 1/20 0.35
PPARG P37231 1/20 0.35
PPARD Q03181 1/20 0.35
PPARA Q07869 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
SCHEMBL7188621 0.89 MAPK1 (0.48) MAPK1EPHX2TP53SMN1; SMN2S1PR1
SCHEMBL7175898 0.88 SMN1; SMN2 (0.37) TP53SMN1; SMN2GAAHTTNR1H4
SCHEMBL7180410 0.87 ITGB1 (0.41) TP53SMN1; SMN2TSHR
SCHEMBL7177602 0.87 L3MBTL1 (0.41) MAPK1SMN1; SMN2GAAALDH1A1THRB
SCHEMBL7188686 0.86 MAPK1 (0.40) MAPK1EPHX2TP53SMN1; SMN2S1PR1
SCHEMBL7177180 0.86 CACNA1H (0.39) EPHX2SMN1; SMN2TDP1NR1H4ALDH1A1
SCHEMBL7183087 0.85 MAPK1 (0.49) MAPK1EPHX2TP53SMN1; SMN2S1PR1
SCHEMBL7188520 0.85 ITGB1 (0.44) TP53S1PR1S1PR5THRBTSHR
SCHEMBL7180869 0.85 MAPK1 (0.46) MAPK1EPHX2TP53SMN1; SMN2S1PR1
SCHEMBL7182347 0.84 MAPK1 (0.39) MAPK1EPHX2TP53SMN1; SMN2S1PR1

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 MAPK1 1801/4885EPHX2 2476/4885TP53 3575/4885
US-20010031898-A1 Organometallic monoacylarylphosphines NAF1, DHCR24, CBR1 MAPK1 2710/4885EPHX2 2048/4885TP53 3524/4885

“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.