SCHEMBL30875422

SCHEMBL30875422

c1cc2cc(C3CC3)c(-c3cn[nH]c3)nc2cn1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ROCK2 O75116 1/20 0.39
▸ LATS1 O95835 9/20 0.38
▸ LATS2 Q9NRM7 4/20 0.38
▸ PIM1 P11309 1/20 0.35
▸ FAAH O00519 1/20 0.35
▸ MAPT P10636 2/20 0.34
▸ CDK2 P24941 1/20 0.34
▸ FLT3 P36888 1/20 0.34
▸ CCNA1 P78396 1/20 0.34
▸ STING1 Q86WV6 1/20 0.34
▸ HIPK2 Q9H2X6 1/20 0.34
▸ CYP11B1 P15538 1/20 0.34
▸ CYP11B2 P19099 1/20 0.34
▸ ADORA2A P29274 1/20 0.34
▸ ADORA1 P30542 1/20 0.34
▸ PIP4K2A P48426 1/20 0.33

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
SCHEMBL27091101 0.68 AKT1 (0.43) ROCK2FAAHCDK2FLT3CCNA1
SCHEMBL1519772 0.63 TDO2 (0.49) ROCK2PIM1MAPTCDK2HIPK2
SCHEMBL3373407 0.60 AKT2 (0.64) ROCK2MAPT
SCHEMBL31123095 0.60 CDK2 (0.63) ROCK2PIM1CDK2FLT3CCNA1
SCHEMBL19398637 0.59 AKT1 (0.52) ROCK2HIPK2
SCHEMBL30616953 0.57 AKT2 (0.48) PIM1MAPTCDK2FLT3CCNA1
SCHEMBL29077582 0.57 AKT2 (0.48) ROCK2PIM1CDK2FLT3CCNA1
SCHEMBL27091366 0.57 AKT2 (0.48) PIM1MAPTCDK2FLT3CCNA1
SCHEMBL20272947 0.57 CLK1 (0.48) MAPT
SCHEMBL19914002 0.56 PIM1 (0.40) ROCK2PIM1HIPK2CYP11B1CYP11B2

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-20240050428-A1 COMPOUNDS AND METHODS OF TREATING CANCERS CULLGEN (SHANGHAI), INC. (CN) 2024-02-15 — — 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-20240050428-A1 COMPOUNDS AND METHODS OF TREATING CANCERS GSPT1, GGT1, VHL ROCK2 3267/4885LATS1 3522/4885LATS2 3960/4885

“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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