SCHEMBL29360668

SCHEMBL29360668

[2H]c1c[nH]c(-c2ccc(C)cc2)n1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 2/20 0.66
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 2/20 0.41
MTOR P42345 1/20 0.39
ADK P55263 1/20 0.39
DCUN1D1 Q96GG9 1/20 0.38
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
CYP2D6 P10635 1/20 0.38
CYP19A1 P11511 1/20 0.38
NR1H2 P55055 1/20 0.36
NR1H3 Q13133 1/20 0.36
MEN1 O00255 2/20 0.34
MAPT P10636 2/20 0.34
KMT2A Q03164 2/20 0.34
LMNA P02545 2/20 0.34
PDE4A P27815 1/20 0.34
PDE4B Q07343 1/20 0.34

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
SCHEMBL30359094 0.79 NISCH (0.42) NISCHALDH1A1KDM4EMTORADK
SCHEMBL30519171 0.79 HDAC6 (0.45) NISCHALDH1A1KDM4EMTORADK
SCHEMBL674010 0.79 NISCH (1.00) NISCHALDH1A1KDM4EMTORADK
2-Phenylimidazole SCHEMBL29356009 0.79 NISCH (0.63) NISCHALDH1A1KDM4EMTORADK
SCHEMBL27974204 0.78 NISCH (0.96) NISCHALDH1A1KDM4EMTORADK
SCHEMBL28110769 0.78 NISCH (0.96) NISCHALDH1A1KDM4EMTORADK
SCHEMBL28230038 0.78 NISCH (0.96) NISCHALDH1A1KDM4EMTORADK
SCHEMBL27451043 0.78 NISCH (0.96) NISCHALDH1A1KDM4EMTORADK
SCHEMBL722191 0.66 NISCH (0.78) NISCHALDH1A1KDM4EMTORADK
SCHEMBL29446956 0.66

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250188072-A1 COMPOUNDS FOR TREATMENT OF CANCER UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2025-06-12 US disclosed
US-12187720-B2 Compounds for treatment of cancer UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2025-01-07 US disclosed
US-11465987-B2 Compounds for treatment of cancer Oncternal Therapeutics, Inc. (US) 2022-10-11 US disclosed
US-20220024912-A1 COMPOUNDS FOR TREATMENT OF CANCER Oncternal Therapeutics, Inc. (US) 2022-01-27 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 (4 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-12187720-B2 Compounds for treatment of cancer KLK3, BRDT, ACP3 NISCH 3272/4885ALDH1A1 209/4885KDM4E 1179/4885
US-20220024912-A1 COMPOUNDS FOR TREATMENT OF CANCER KLK3, BRDT, ACP3 NISCH 3272/4885ALDH1A1 209/4885KDM4E 1179/4885
US-20250188072-A1 COMPOUNDS FOR TREATMENT OF CANCER KLK3, BRDT, ACP3 NISCH 3272/4885ALDH1A1 209/4885KDM4E 1179/4885
US-11465987-B2 Compounds for treatment of cancer KLK3, BRDT, ACP3 NISCH 3272/4885ALDH1A1 209/4885KDM4E 1179/4885

“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.