SCHEMBL29914871

SCHEMBL29914871

Fc1cc(-c2ccccn2)c(F)cc1-c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 3/20 0.47
KDM4E B2RXH2 4/20 0.46
LMNA P02545 2/20 0.46
CCR1 P32246 2/20 0.46
CCR5 P51681 2/20 0.46
CCR8 P51685 2/20 0.46
CYP1A2 P05177 1/20 0.46
POLB P06746 1/20 0.46
METAP1 P53582 1/20 0.46
BLM P54132 1/20 0.46
HIF1A Q16665 1/20 0.46
DOHH Q9BU89 1/20 0.46
P4HTM Q9NXG6 1/20 0.46
TOP1 P11387 4/20 0.43
GRM5 P41594 3/20 0.43
CYP2A6 P11509 1/20 0.43
MAPK14 Q16539 1/20 0.43
KDR P35968 1/20 0.42
TP53 P04637 3/20 0.41
RAB9A P51151 2/20 0.41

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
SCHEMBL5844795 0.86 KDM4E (0.52) TGFBR1KDM4ELMNACCR1CCR5
SCHEMBL31400260 0.84 KDM4E (0.54) TGFBR1KDM4ELMNACCR1CCR5
SCHEMBL12377643 0.84 KDM4E (0.54) TGFBR1KDM4ELMNACCR1CCR5
Hydrochloric Acid SCHEMBL27906275 0.82 KDM4E (0.52) TGFBR1KDM4ELMNACCR1CCR5
SCHEMBL28463441 0.82 TOP1 (0.51) TGFBR1KDM4ELMNACCR1CCR5
SCHEMBL28714020 0.82 TOP1 (0.51) TGFBR1KDM4ELMNACCR1CCR5
SCHEMBL17744704 0.80 KDM4E (0.45) KDM4ELMNACCR1CCR5CCR8
SCHEMBL19831559 0.80 KDM4E (0.43) TGFBR1KDM4ELMNACCR1CCR5
SCHEMBL5402168 0.79 BACE1 (0.50) LMNACYP1A2HIF1ACYP2A6MAPK1
SCHEMBL7496516 0.79 KDM4E (0.48) KDM4ELMNACCR1CCR5CCR8

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-11444250-B2 Composition of matter for use in organic light-emitting diodes KYULUX, INC. (JP) 2022-09-13 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-11444250-B2 Composition of matter for use in organic light-emitting diodes CRY2, ALDH1A2, CYBA TGFBR1 3414/4885KDM4E 4374/4885LMNA 1149/4885

“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.