SCHEMBL26315417

SCHEMBL26315417

Cc1ncnc2ccc(C=O)cc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.48
KDM4E B2RXH2 5/20 0.48
MEN1 O00255 3/20 0.48
POLB P06746 3/20 0.48
KMT2A Q03164 3/20 0.48
NPC1 O15118 2/20 0.48
MAPT P10636 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
RAB9A P51151 2/20 0.48
HPGD P15428 1/20 0.48
PTK2B Q14289 1/20 0.48
IP6K1 Q92551 2/20 0.41
CYP2A6 P11509 1/20 0.38
BRD4 O60885 2/20 0.37
TSHR P16473 2/20 0.35
KIF11 P52732 1/20 0.35
LMNA P02545 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C19 P33261 1/20 0.35
HIF1A Q16665 1/20 0.35

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
SCHEMBL2877598 0.79 MAP4K4 (0.51) IP6K1
SCHEMBL496927 0.79 PDE4A (0.48) ALDH1A1KDM4EMEN1POLBKMT2A
SCHEMBL2882274 0.78 CYP1A2 (0.50) ALDH1A1KDM4ESMN1; SMN2HPGDTSHR
SCHEMBL2880423 0.78 ALDH1A1 (0.43) ALDH1A1KDM4EMEN1POLBKMT2A
SCHEMBL31092634 0.78 ALDH1A1 (0.43) ALDH1A1KDM4EMEN1POLBKMT2A
SCHEMBL2880252 0.78 CYP1A2 (0.55) ALDH1A1MEN1KMT2AHPGDCYP2A6
SCHEMBL13861996 0.78 ALDH1A1 (0.38) ALDH1A1KDM4EMEN1POLBKMT2A
SCHEMBL3861852 0.76 ALDH1A1 (0.45) ALDH1A1KDM4EMEN1POLBKMT2A
SCHEMBL29935762 0.75 SMN1; SMN2 (0.47) ALDH1A1KDM4EMEN1POLBKMT2A
SCHEMBL4585191 0.75 SMN1; SMN2 (0.47) ALDH1A1KDM4EMEN1POLBKMT2A

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-20230293519-A1 INTEGRIN INHIBITORS AND USES THEREOF IN COMBINATION WITH OTHER AGENTS PLIANT THERAPEUTICS INC (US) 2023-09-21 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-20230293519-A1 INTEGRIN INHIBITORS AND USES THEREOF IN COMBINATION WITH OTHER AGENTS ITGB6, ITGA5, ITGAV ALDH1A1 2893/4885KDM4E 3196/4885MEN1 3937/4885

“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.