SCHEMBL21765002

SCHEMBL21765002

CCOCCn1cc(-c2ccccc2Nc2cccc(C(F)(F)F)c2)cn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ LMNA P02545 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ TEAD1 P28347 2/20 0.40
▸ KCNH2 Q12809 1/20 0.40
▸ FGFR1 P11362 2/20 0.40
▸ DDR2 Q16832 2/20 0.40
▸ YAP1 P46937 1/20 0.39
▸ TEAD4 Q15561 1/20 0.39
▸ TEAD2 Q15562 1/20 0.39
▸ ALK Q9UM73 1/20 0.39
▸ CDK2 P24941 1/20 0.39
▸ GSK3B P49841 1/20 0.39
▸ TP53 P04637 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
SCHEMBL21749289 0.86 PDK2 (0.50) ALDH1A1GAAMAPTRAB9ASMN1; SMN2
SCHEMBL20553196 0.83 GRIN1 (0.45) LMNACYP1A2CYP2C9CYP2C19FGFR1
SCHEMBL20551821 0.80 PDK2 (0.52) ALDH1A1GAAMAPTRAB9ASMN1; SMN2
SCHEMBL25786706 0.76 PDK2 (0.43) FGFR1DDR2
SCHEMBL21764712 0.73 PDK2 (0.50) —
SCHEMBL20552657 0.72 JAK1 (0.43) MAPT
SCHEMBL20552120 0.71 YAP1 (0.46) ALDH1A1GAAMAPTRAB9ASMN1; SMN2
SCHEMBL25786733 0.71 PDK2 (0.46) FGFR1DDR2
SCHEMBL21749242 0.70 TP53 (0.44) ALDH1A1GAAMAPTRAB9ASMN1; SMN2
SCHEMBL20552230 0.69 ALDH1A1 (0.45) ALDH1A1GAAMAPTRAB9ASMN1; SMN2

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-11186554-B2 Non-fused tricyclic compounds VIVACE THERAPEUTICS, INC. (US) 2021-11-30 — — US disclosed
US-20200062721-A1 NON-FUSED TRICYCLIC COMPOUNDS VIVACE THERAPEUTICS, INC. 2020-02-27 — — 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 (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-20200062721-A1 NON-FUSED TRICYCLIC COMPOUNDS YAP1, MYC, TEAD2 ALDH1A1 3497/4885GAA 3437/4885MAPT 1705/4885
US-11186554-B2 Non-fused tricyclic compounds YAP1, MYC, TEAD2 ALDH1A1 3497/4885GAA 3437/4885MAPT 1705/4885

“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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