SCHEMBL21884674

SCHEMBL21884674

CCCCCCC(C)(CCCCCC)c1ccnnc1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 15/20 0.38
▸ CNR1 P21554 10/20 0.38
▸ TDP1 Q9NUW8 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ KCNH2 Q12809 1/20 0.31

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
SCHEMBL21191600 1.00 CNR2 (0.38) CNR2CNR1TDP1L3MBTL1KCNH2
SCHEMBL21191796 1.00 CNR2 (0.38) CNR2CNR1TDP1L3MBTL1KCNH2
SCHEMBL19738702 0.98 CNR2 (0.37) CNR2CNR1TDP1L3MBTL1
SCHEMBL18869370 0.98 CNR2 (0.37) CNR2CNR1TDP1L3MBTL1
SCHEMBL22024290 0.98 CNR2 (0.36) CNR2CNR1TDP1L3MBTL1
SCHEMBL21718495 0.93 CNR2 (0.36) CNR2CNR1TDP1L3MBTL1
SCHEMBL19738148 0.93 ESR1 (0.35) CNR2CNR1TDP1L3MBTL1
SCHEMBL19738659 0.90 ESR1 (0.33) CNR2CNR1
SCHEMBL19738625 0.86 ESR1 (0.33) CNR2CNR1
SCHEMBL19738629 0.86 CNR2 (0.47) CNR2CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230075221-A1 SUBSTITUTED 1,2,4-TRIAZOLO[4,3-A]PYRIDINE DERIVATIVE AND PREPARATION METHOD, HERBICIDAL COMPOSITION AND APPLICATION THEREOF QINGDAO KINGAGROOT CHEMICAL COMPOUND CO., LTD. (CN) 2023-03-09 — — US disclosed
US-10889571-B2 Substituted benzoimidazoles and imidazo[4,5-c]pyridines for treating certain leukemias Terns, Inc. (US) 2021-01-12 — — US disclosed
US-20200087283-A1 COMPOUNDS FOR TREATING CERTAIN LEUKEMIAS Terns, Inc. (US) 2020-03-19 — — 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 (3 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-20200087283-A1 COMPOUNDS FOR TREATING CERTAIN LEUKEMIAS ABL1, ABL2, BCR CNR2 4682/4885CNR1 4740/4885TDP1 2132/4885
US-20230075221-A1 SUBSTITUTED 1,2,4-TRIAZOLO[4,3-A]PYRIDINE DERIVATIVE AND PREPARATION METHOD, HERBICIDAL COMPOSITION AND APPLICATION THEREOF TH, CYP4X1, CYP4B1 CNR2 1527/4885CNR1 1357/4885TDP1 1692/4885
US-10889571-B2 Substituted benzoimidazoles and imidazo[4,5-c]pyridines for treating certain leukemias ABL1, ABL2, BCR CNR2 4035/4885CNR1 4256/4885TDP1 2576/4885

“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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