SCHEMBL6736398

SCHEMBL6736398

CCc1ccc2cc3c(F)c(F)c(F)cc3cc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.48
CYP2A6 P11509 1/20 0.48
AKR1C3 P42330 1/20 0.37
AKR1C2 P52895 1/20 0.37
LMNA P02545 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
RAB9A P51151 1/20 0.34
PTK2B Q14289 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TRPA1 O75762 1/20 0.33
CYP19A1 P11511 1/20 0.33
DAO P14920 1/20 0.31
KIF11 P52732 1/20 0.31
ELANE P08246 1/20 0.31
TAAR1 Q96RJ0 1/20 0.31

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
SCHEMBL6735680 1.00 CYP1A2 (0.48) CYP1A2CYP2A6AKR1C3AKR1C2LMNA
SCHEMBL6737669 0.89 CNR1 (0.39) CYP1A2CYP2A6MEN1KMT2ANPC1
SCHEMBL6738566 0.89 CNR1 (0.39) CYP1A2CYP2A6MEN1KMT2ANPC1
SCHEMBL6735936 0.87 CYP1A2 (0.46) CYP1A2CYP2A6AKR1C3AKR1C2LMNA
SCHEMBL6736855 0.87 CYP1A2 (0.46) CYP1A2CYP2A6AKR1C3AKR1C2LMNA
SCHEMBL6736230 0.86 SKP2 (0.37) CYP1A2CYP2A6HTR1ABDKRB2
SCHEMBL6734879 0.86 SKP2 (0.37) CYP1A2CYP2A6HTR1ABDKRB2
SCHEMBL6741483 0.85 HTR2A (0.39) LMNAALDH1A1HTR1AHTR1DHTR1B
SCHEMBL14604945 0.83 CYP1A2 (0.61) CYP1A2CYP2A6AKR1C3AKR1C2LMNA
SCHEMBL6731268 0.83 CYP1A2 (0.42) CYP1A2CYP2A6AKR1C3AKR1C2LMNA

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-6682785-B2 A FLUOROANTHRACENE COMPOUNDS; HEAT RESISTANCE, RADIATION RESISTANCE, PHOTOSTABILITY CLARIANT FINANCE (BVI) LIMITED (VG) 2004-01-27 US disclosed
US-20030118749-A1 A fluoroanthracene compounds; heat resistance, radiation resistance, photostability CLARIANT INTERNATIONAL LTD. 2003-06-26 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-20030118749-A1 A fluoroanthracene compounds; heat resistance, radiation resistance, photostability HSF1, ABCC1, FLNA CYP1A2 80/4885CYP2A6 1066/4885AKR1C3 1598/4885

“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.