SCHEMBL16675476

SCHEMBL16675476

CC(=O)C(O)(c1c[nH]c2ccccc12)C(F)(F)F

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.49
PBRM1 Q86U86 1/20 0.49
SLC22A6 Q4U2R8 1/20 0.45
CTNNB1 P35222 1/20 0.44
WNT3A P56704 1/20 0.44
GPR84 Q9NQS5 1/20 0.44
CYP1A2 P05177 2/20 0.43
CYP2C19 P33261 2/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
NR4A2 P43354 1/20 0.42
CREBBP Q92793 1/20 0.42
GSK3B P49841 1/20 0.42
ALDH1A1 P00352 2/20 0.41
ATM Q13315 1/20 0.41
LMNA P02545 2/20 0.40
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
PKM P14618 1/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL4255993 0.86 MAPK1 (0.50) MAPK1PBRM1CTNNB1WNT3AGPR84
SCHEMBL3583719 0.81 PKM (0.50) CYP1A2CYP2C19CYP3A4CYP2C9ALDH1A1
SCHEMBL2828189 0.79 MAPK1 (0.50) MAPK1PBRM1CTNNB1WNT3AGPR84
SCHEMBL2831241 0.78 MAPK1 (0.46) MAPK1PBRM1SLC22A6CTNNB1WNT3A
SCHEMBL25139960 0.78 PBRM1 (0.54) MAPK1PBRM1SLC22A6GPR84CYP1A2
SCHEMBL17866727 0.78 PBRM1 (0.54) MAPK1PBRM1SLC22A6GPR84CYP1A2
SCHEMBL27379245 0.75 MAPK1 (0.48) MAPK1PBRM1SLC22A6CTNNB1WNT3A
SCHEMBL15245639 0.74 MAPK1 (0.47) MAPK1PBRM1CTNNB1WNT3AGPR84
SCHEMBL5174863 0.73 PBRM1 (0.49) MAPK1PBRM1SLC22A6CTNNB1WNT3A
SCHEMBL5172407 0.73 PBRM1 (0.49) MAPK1PBRM1SLC22A6CTNNB1WNT3A

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-11737462-B2 Methods for modulating plant response to environmentally-induced stress HOWARD UNIVERSITY (US) 2023-08-29 US disclosed
US-20150119250-A1 METHODS FOR MODULATING PLANT RESPONSE TO ENVIRONMENTALLY-INDUCED STRESS GEORGETOWN UNIVERSITY 2015-04-30 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-11737462-B2 Methods for modulating plant response to environmentally-induced stress RACK1, ROS1, HSF1 MAPK1 92/4885PBRM1 3700/4885SLC22A6 4848/4885
US-20150119250-A1 METHODS FOR MODULATING PLANT RESPONSE TO ENVIRONMENTALLY-INDUCED STRESS RACK1, ROS1, HSF1 MAPK1 92/4885PBRM1 3700/4885SLC22A6 4848/4885

“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.