SCHEMBL31653799

SCHEMBL31653799

CCc1nc2n(CC(=O)Nc3ccc(C(F)(F)F)cc3)c3ccccc3n2c(=O)c1Br

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ KDM4E B2RXH2 3/20 0.45
▸ AKR1B1 P15121 1/20 0.44
▸ MAPT P10636 5/20 0.43
▸ TP53 P04637 2/20 0.43
▸ GAA P10253 1/20 0.43
▸ RXFP1 Q9HBX9 2/20 0.43
▸ KAT2B Q92831 2/20 0.42
▸ LMNA P02545 3/20 0.42
▸ RECQL P46063 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ TRPA1 O75762 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ KDR P35968 1/20 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
SCHEMBL31678822 0.87 KDM4E (0.44) ALDH1A1KDM4EAKR1B1MAPTTP53
SCHEMBL31653720 0.84 ALDH1A1 (0.42) ALDH1A1HPGDHTTKDM4EAKR1B1
SCHEMBL31677760 0.82 KDM4E (0.43) KDM4EAKR1B1MAPTTP53RXFP1
SCHEMBL31653952 0.81 KDM4E (0.44) ALDH1A1HPGDHTTKDM4EAKR1B1
SCHEMBL31653785 0.81 MAPT (0.45) ALDH1A1HPGDHTTKDM4EAKR1B1
SCHEMBL31653782 0.80 MAPT (0.42) ALDH1A1HPGDHTTKDM4EAKR1B1
SCHEMBL31664556 0.80 AKR1B1 (0.45) ALDH1A1HPGDHTTKDM4EAKR1B1
SCHEMBL31653818 0.80 MAPT (0.40) ALDH1A1HPGDHTTKDM4EAKR1B1
SCHEMBL31677892 0.79 KDM4E (0.43) KDM4EAKR1B1MAPTTP53RXFP1
SCHEMBL31653843 0.78 TP53 (0.41) ALDH1A1HPGDHTTKDM4EAKR1B1

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-20250215006-A1 TRICYCLIC COMPOUNDS AS INHIBITORS OF WRN INCYTE CORPORATION (US) 2025-07-03 — — 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-20250215006-A1 TRICYCLIC COMPOUNDS AS INHIBITORS OF WRN WRN, BLM, RECQL ALDH1A1 2532/4885HPGD 840/4885HTT 1437/4885

“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.

Send feedback