SCHEMBL3249688

SCHEMBL3249688

CC(c1[c]c2ccccc2cc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.33
UGT2B7 P16662 1/20 0.32
KMT2A Q03164 1/20 0.32
TAAR1 Q96RJ0 2/20 0.31
DAO P14920 1/20 0.31
ADRA2A P08913 1/20 0.31
ADRA2C P18825 1/20 0.31
CYP2D6 P10635 1/20 0.31
LMNA P02545 1/20 0.31
HIF1A Q16665 1/20 0.31
KDM4E B2RXH2 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
SCHEMBL198668 0.80 UGT2B7 (0.36) UGT2B7LMNAKDM4E
SCHEMBL3245690 0.78 TSHR (0.37) CYP2D6KDM4E
SCHEMBL3248018 0.78 CYP3A4 (0.30) CYP2D6
SCHEMBL3240095 0.77 SMN1; SMN2 (0.35) KMT2AADRA2ACYP2D6LMNAKDM4E
SCHEMBL6038386 0.77 HTR2A (0.35) UGT2B7
SCHEMBL6887508 0.77 UGT2B7 (0.31) UGT2B7
SCHEMBL295332 0.77 UGT2B7 (0.31) UGT2B7
SCHEMBL6896467 0.76
SCHEMBL2502578 0.74 TSHR (0.37)
SCHEMBL2498027 0.74 CYP1A2 (0.31)

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-11787757-B2 Phenol derivative, and preparation process and use thereof CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2023-10-17 US disclosed
CN-111056923-A Phenol derivative and preparation method and application thereof 中国石油化工股份有限公司 2020-04-24 CN disclosed
WO-2010002802-A1 PYRROLIDINE-SUBSTITUTED AZAINDOLE COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY MEMORY PHARMACEUTICALS CORPORATION (US) 2010-01-07 WO disclosed
US-4010033-A PHOTOCHROMIC SPIROPYRANE, NITROGEN-CONTAINING THIOETHER AGENCE NATIONALE DE VALORISATION DE LA RECHERCHE (ANVAR) (FR) 1977-03-01 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-11787757-B2 Phenol derivative, and preparation process and use thereof PTGES, PPARG, PTGES3 TYR 258/4885UGT2B7 839/4885KMT2A 3928/4885

“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.