SCHEMBL25788910

SCHEMBL25788910

CCn1nnc(-c2cc(C(F)F)ccc2Nc2ccc(C(F)(F)C(=O)OCc3ccccc3)cc2)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ HTT P42858 2/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ TSHR P16473 5/20 0.38
▸ CYP1A2 P05177 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ HPGD P15428 2/20 0.37
▸ CYP26A1 O43174 1/20 0.36
▸ MAPT P10636 4/20 0.36
▸ TP53 P04637 2/20 0.36
▸ MEN1 O00255 4/20 0.35
▸ KMT2A Q03164 4/20 0.35
▸ THRB P10828 2/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ ADRB2 P07550 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.34
▸ XPO1 O14980 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
SCHEMBL25788866 0.92 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2LMNAHTTTDP1
SCHEMBL25786689 0.76 SMN1; SMN2 (0.41) ALDH1A1SMN1; SMN2LMNAHTTTDP1
SCHEMBL25781529 0.75 MAPT (0.38) ALDH1A1SMN1; SMN2LMNAMAPTTP53
SCHEMBL20552622 0.75 HDAC6 (0.39) ALDH1A1LMNAMAPTTP53THRB
SCHEMBL25788904 0.71 LMNA (0.33) ALDH1A1LMNACYP1A2CYP2C9MAPT
SCHEMBL25788826 0.69 SMN1; SMN2 (0.38) ALDH1A1SMN1; SMN2LMNAHTTTSHR
SCHEMBL25788637 0.68 MAPK1 (0.36) ALDH1A1SMN1; SMN2LMNAHTTTSHR
SCHEMBL25788810 0.68 TP53 (0.35) ALDH1A1SMN1; SMN2LMNAHTTTSHR
SCHEMBL20552644 0.67 HDAC6 (0.42) ALDH1A1LMNAMAPTTP53MEN1
SCHEMBL25781525 0.67 MAPT (0.43) ALDH1A1SMN1; SMN2LMNAMAPTTP53

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-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-06-22 — — 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-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF TEAD1, TEAD4, TEAD2 ALDH1A1 3323/4885SMN1; SMN2 3035/4885LMNA 2451/4885

“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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