SCHEMBL6403714

SCHEMBL6403714

Cc1cc(C(C)(C)C)cc(C)c1C(=O)C(C)(P=O)C(=O)c1c(C)cc(C(C)(C)C)cc1C

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.38
RXRB P28702 6/20 0.37
GABRA1 P14867 1/20 0.35
GABRB2 P47870 1/20 0.35
HTR1D P28221 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
HTR1B P28222 1/20 0.34
RXRA P19793 5/20 0.34
ALDH1A1 P00352 4/20 0.34
TSHR P16473 2/20 0.34
HPGD P15428 1/20 0.34
RAB9A P51151 1/20 0.34
RXRG P48443 2/20 0.33
ACHE P22303 1/20 0.33
ESR1 P03372 1/20 0.31
NPSR1 Q6W5P4 1/20 0.30
ELANE P08246 1/20 0.30

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
SCHEMBL5996436 0.95 RXRB (0.37) POLBRXRBGABRA1GABRB2HTR1D
SCHEMBL2499311 0.86 KDM4E (0.41) MEN1KMT2AALDH1A1HPGDNPSR1
SCHEMBL6399268 0.84 CYP3A4 (0.40) MEN1KMT2ATSHRHPGD
SCHEMBL5997923 0.79 L3MBTL1 (0.36) MEN1KMT2AALDH1A1HPGDNPSR1
SCHEMBL152305 0.78 TDP1 (0.37) GABRA1GABRB2ALDH1A1HPGDRAB9A
SCHEMBL5994813 0.75 ALDH1A1 (0.36) POLBMEN1KMT2AALDH1A1ACHE
SCHEMBL5996314 0.74 MEN1 (0.40) POLBMEN1KMT2AALDH1A1RAB9A
SCHEMBL5996157 0.73 KDM4E (0.38) POLBGABRA1GABRB2MEN1KMT2A
SCHEMBL501929 0.73 POLB (0.44) POLBRXRBGABRA1GABRB2HTR1D
SCHEMBL112083 0.73 POLB (0.44) POLBRXRBGABRA1GABRB2HTR1D

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-6969733-B2 Photoinitiators CIBA SPECIALTY CHEMICALS CORPORATION (US) 2005-11-29 US disclosed
US-20030139485-A1 Photoinitiators WOLF JEAN-PIERRE (CH) 2003-07-24 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-20030139485-A1 Photoinitiators DHCR24, NR1I3, CBR1 POLB 1422/4885RXRB 550/4885GABRA1 2372/4885

“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.