SCHEMBL21164720

SCHEMBL21164720

O=C(O)c1ccc(-c2c3ccccc3cc3ccccc23)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.55
MEN1 O00255 1/20 0.55
ALDH1A1 P00352 1/20 0.55
CYP1A2 P05177 1/20 0.55
GLA P06280 1/20 0.55
HPGD P15428 1/20 0.55
CYP2C19 P33261 1/20 0.55
KMT2A Q03164 1/20 0.55
HSD17B10 Q99714 1/20 0.55
ALOX5 P09917 1/20 0.53
TTR P02766 1/20 0.50
EGFR P00533 1/20 0.49
GRIN2D O15399 1/20 0.47
GRIN2A Q12879 1/20 0.47
GRIN2C Q14957 1/20 0.47
PTPN1 P18031 1/20 0.47
WDR5 P61964 1/20 0.47
RXRA P19793 1/20 0.47
RXRB P28702 1/20 0.47
TSHR P16473 2/20 0.46

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
SCHEMBL21164721 0.98 KDM4E (0.53) KDM4EMEN1ALDH1A1CYP1A2GLA
SCHEMBL30287529 0.93 KDM4E (0.49) KDM4EMEN1ALDH1A1CYP1A2GLA
SCHEMBL20494622 0.93 KDM4E (0.49) KDM4EMEN1ALDH1A1CYP1A2GLA
SCHEMBL21164777 0.92 CYP1A2 (0.47) KDM4EMEN1ALDH1A1CYP1A2GLA
SCHEMBL24222067 0.87 TTR (0.49) KDM4EMEN1ALDH1A1CYP1A2GLA
SCHEMBL30079577 0.87 TTR (0.49) KDM4EMEN1ALDH1A1CYP1A2GLA
SCHEMBL22435143 0.87 TTR (0.52) CYP1A2CYP2C19HSD17B10ALOX5TTR
SCHEMBL29388499 0.86 TTR (0.59) HPGDTTREGFRRXRARXRB
SCHEMBL6350818 0.86 TTR (0.59) HPGDTTREGFRRXRARXRB
SCHEMBL28601450 0.81 ATM (0.57) KDM4EMEN1ALDH1A1HPGDKMT2A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10351580-B2 Acene-based transmitter molecules for photon upconversion THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2019-07-16 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-10351580-B2 Acene-based transmitter molecules for photon upconversion ACE, ACE2, AGTR1 KDM4E 4392/4885MEN1 1290/4885ALDH1A1 93/4885

“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.