SCHEMBL24016771

SCHEMBL24016771

CC(C)(C)c1cccnc1-n1nnc2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.53
▸ ATM Q13315 2/20 0.44
▸ ALDH1A1 P00352 5/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ LMNA P02545 4/20 0.43
▸ GAA P10253 1/20 0.42
▸ KCNMA1 Q12791 1/20 0.42
▸ SLC9A1 P19634 2/20 0.41
▸ KEAP1 Q14145 1/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ TSHR P16473 2/20 0.40
▸ ESR1 P03372 1/20 0.39
▸ NPC1 O15118 1/20 0.38
▸ MAPK1 P28482 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ POLB P06746 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38

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
SCHEMBL17570759 0.77 KCNMA1 (0.61) RAB9AATMALDH1A1KDM4EKMT2A
SCHEMBL6067788 0.73 KCNMA1 (0.53) RAB9AATMALDH1A1KDM4EKMT2A
SCHEMBL16796215 0.72 RAB9A (0.68) RAB9AATMALDH1A1KDM4EKMT2A
SCHEMBL3163648 0.71 ALDH1A1 (0.61) RAB9AALDH1A1KMT2ALMNAGAA
SCHEMBL25951422 0.71 ALDH1A1 (0.47) RAB9AATMALDH1A1KDM4EKMT2A
SCHEMBL24743260 0.71 RAB9A (0.57) RAB9AATMALDH1A1KDM4EKMT2A
SCHEMBL27447734 0.70 SMN1; SMN2 (0.48) RAB9AATMALDH1A1KDM4EKMT2A
SCHEMBL23936583 0.70 KCNMA1 (0.51) RAB9AATMALDH1A1KDM4EKMT2A
SCHEMBL12204536 0.69 SMN1; SMN2 (0.54) RAB9AATMALDH1A1KDM4EKMT2A
SCHEMBL678640 0.69 RAB9A (1.00) RAB9AATMALDH1A1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11905252-B2 Compounds INFLAZOME LIMITED (IE) 2024-02-20 — — US disclosed
US-20210347737-A1 NOVEL COMPOUNDS INFLAZOME LIMITED (IE) 2021-11-11 — — 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 (2 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-11905252-B2 Compounds NLRP3, NOD1, PYCARD RAB9A 3000/4885ATM 4450/4885ALDH1A1 559/4885
US-20210347737-A1 NOVEL COMPOUNDS NOD1, NLRP3, NOD2 RAB9A 3156/4885ATM 4360/4885ALDH1A1 1032/4885

“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.

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