SCHEMBL19798858

SCHEMBL19798858

COc1ccc2cc(C(C)(C)C)ccc2c1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDO2 P48775 1/20 0.46
▸ NR1I2 O75469 1/20 0.41
▸ METAP2 P50579 1/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ MAPK14 Q16539 1/20 0.40
▸ KMT2A Q03164 1/20 0.39
▸ ALDH1A1 P00352 4/20 0.38
▸ KDM2B Q8NHM5 2/20 0.38
▸ KDM4E B2RXH2 3/20 0.37
▸ HPGD P15428 3/20 0.37
▸ HSD17B10 Q99714 2/20 0.37
▸ TSHR P16473 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ CA9 Q16790 1/20 0.37
▸ WDR5 P61964 1/20 0.36
▸ MAPT P10636 1/20 0.36

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
SCHEMBL2047967 0.84 MAPT (0.52) TDO2NR1I2METAP2SMN1; SMN2MAPK14
SCHEMBL19798872 0.81 LMNA (0.45) TDO2METAP2SMN1; SMN2L3MBTL1LMNA
SCHEMBL20043184 0.79 TDO2 (0.44) TDO2NR1I2METAP2SMN1; SMN2MAPK14
SCHEMBL806517 0.78 ACHE (0.54) L3MBTL1LMNAKMT2AALDH1A1KDM2B
SCHEMBL19798861 0.77 KDM2B (0.45) KDM2B
SCHEMBL16160155 0.77 MAPK14 (0.47) TDO2NR1I2METAP2MAPK14KMT2A
SCHEMBL30503987 0.77 CA12 (0.52) KMT2AALDH1A1CA1CA2CA9
SCHEMBL4194130 0.77 CA12 (0.52) KMT2AALDH1A1CA1CA2CA9
SCHEMBL13335867 0.76 CYP3A4 (0.50) TDO2METAP2SMN1; SMN2ALDH1A1CA1
SCHEMBL195044 0.75 KDM4E (0.53) METAP2SMN1; SMN2KMT2AALDH1A1KDM4E

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-10280149-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2019-05-07 — — US disclosed
US-20180022727-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2018-01-25 — — US disclosed
US-20180022727-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2018-01-25 — — 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-10280149-B2 Therapeutic compounds and uses thereof KDM1B, KDM6B, KDM2B TDO2 3036/4885NR1I2 1527/4885METAP2 2598/4885
US-20180022727-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF KDM1B, KDM6B, KDM2B TDO2 3036/4885NR1I2 1527/4885METAP2 2598/4885

“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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