SCHEMBL24397149

SCHEMBL24397149

CCOc1c2cc[nH]c2c(OCC)c2cc[nH]c12

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TTBK1 Q5TCY1 1/20 0.37
TTBK2 Q6IQ55 1/20 0.37
NQO1 P15559 1/20 0.37
NUDT1 P36639 1/20 0.36
ELANE P08246 3/20 0.35
BRD4 O60885 2/20 0.35
CCR8 P51685 1/20 0.32
P2RX7 Q99572 2/20 0.32
BRD2 P25440 1/20 0.32
CHUK O15111 1/20 0.32
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31
TSHR P16473 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KCNA2 P16389 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
SCHEMBL9315235 0.70 BCHE (0.35) BRD4KMT2AKDM4EALDH1A1
SCHEMBL15826425 0.70 P2RX7 (0.40) BRD4P2RX7TSHR
SCHEMBL22137566 0.67 HPGD (0.40) TTBK1TTBK2NUDT1ELANEBRD4
SCHEMBL26912258 0.67 P2RX7 (0.44) NUDT1BRD4P2RX7CHUKKDM4E
SCHEMBL12219421 0.66 CCR8 (0.50) BRD4CCR8KMT2ATDP1KDM4E
SCHEMBL2454041 0.65 POLB (0.63) NQO1NUDT1CCR8HTTKMT2A
Ammonia Solution, Strong SCHEMBL4254547 0.64 POLB (0.61) NQO1NUDT1CCR8HTTKMT2A
SCHEMBL827777 0.64 HTR1B (0.59) KMT2ATSHRKDM4EALDH1A1
SCHEMBL27571353 0.64 MAPT (0.52) NQO1KMT2ATSHRTDP1KDM4E
SCHEMBL29366895 0.64 ALDH1A1 (0.50) NQO1ELANEKMT2AKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220149298-A1 PHOTOACTIVE COMPOUNDS FOR VAPOR DEPOSITED ORGANIC PHOTOVOLTAIC DEVICES UBIQUITOUS ENERGY, INC. (US) 2022-05-12 US disclosed
US-20220140266-A1 PHOTOACTIVE COMPOUNDS FOR VAPOR DEPOSITED ORGANIC PHOTOVOLTAIC DEVICES UBIQUITOUS ENERGY, INC. (US) 2022-05-05 US disclosed
US-20220135587-A1 PHOTOACTIVE COMPOUNDS FOR VAPOR DEPOSITED ORGANIC PHOTOVOLTAIC DEVICES UBIQUITOUS ENERGY, INC. (US) 2022-05-05 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 (3 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-20220140266-A1 PHOTOACTIVE COMPOUNDS FOR VAPOR DEPOSITED ORGANIC PHOTOVOLTAIC DEVICES VIM, ALDH1A2, ICAM1 TTBK1 1158/4885TTBK2 1217/4885NQO1 74/4885
US-20220149298-A1 PHOTOACTIVE COMPOUNDS FOR VAPOR DEPOSITED ORGANIC PHOTOVOLTAIC DEVICES VIM, ALDH1A2, ICAM1 TTBK1 1158/4885TTBK2 1217/4885NQO1 74/4885
US-20220135587-A1 PHOTOACTIVE COMPOUNDS FOR VAPOR DEPOSITED ORGANIC PHOTOVOLTAIC DEVICES VIM, ALDH1A2, ICAM1 TTBK1 1158/4885TTBK2 1217/4885NQO1 74/4885

“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.