SCHEMBL18549318

SCHEMBL18549318

CC1(C)C(=O)N(C2CC2)c2cc(C(N)=NO)ccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR7 P34969 1/20 0.40
▸ MEN1 O00255 3/20 0.34
▸ KMT2A Q03164 3/20 0.34
▸ MAPK1 P28482 2/20 0.34
▸ RECQL P46063 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ NFKB1 P19838 1/20 0.33
▸ THPO P40225 1/20 0.33
▸ HIF1A Q16665 1/20 0.33
▸ MAP4K1 Q92918 4/20 0.33
▸ GMNN O75496 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ BLM P54132 1/20 0.32
▸ PMP22 Q01453 1/20 0.32
▸ TNKS O95271 1/20 0.32
▸ F10 P00742 2/20 0.32
▸ MARK3 P27448 4/20 0.31
▸ MARK4 Q96L34 2/20 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
SCHEMBL18549317 1.00 HTR7 (0.40) HTR7MEN1KMT2AMAPK1RECQL
SCHEMBL17275720 0.86 F2 (0.36) MEN1KMT2AMAPK1CYP3A4CYP2D6
SCHEMBL18549359 0.86 MAPK14 (0.40) HTR7MEN1KMT2AMAPK1CYP3A4
SCHEMBL17275731 0.82 L3MBTL1 (0.38) HTR7MEN1KMT2AMAPK1CYP3A4
SCHEMBL16324550 0.80 STING1 (0.40) HTR7MEN1KMT2AMAPK1CYP3A4
SCHEMBL16322085 0.79 ALDH1A1 (0.49) HTR7LMNAKDM4E
SCHEMBL17138112 0.77 TNKS (0.36) MAP4K1TNKSMARK3MARK4
SCHEMBL15579205 0.74 BACE1 (0.41) HTR7KMT2ALMNATNKSMARK3
SCHEMBL17275833 0.73 STING1 (0.39) MEN1KMT2AMAPK1CYP3A4CYP2D6
SCHEMBL16324621 0.72 STING1 (0.36) MEN1KMT2AMAPK1CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10385050-B2 Indolin-2-one and 1,3-dihydro-pyrrolo[3,2-c]pyridin-2-one derivatives HOFFMANN-LA ROCHE INC. (US) 2019-08-20 — — US disclosed
EP-3145923-B1 INDOLIN-2-ONE AND 1,3-DIHYDRO-PYRROLO[3,2-C]PYRIDIN-2-ONE DERIVATIVES HOFFMANN LA ROCHE (CH) 2019-01-30 — — EP disclosed
US-20190016719-A1 INDOLIN-2-ONE AND 1,3-DIHYDRO-PYRROLO[3,2-c]PYRIDIN-2-ONE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2019-01-17 — — US disclosed
US-10112938-B2 Indolin-2-one and 1,3-dihydro-pyrrolo[3,2-c]pyridin-2-one derivatives HOFFMAN-LA ROCHE INC. (US) 2018-10-30 — — US disclosed
US-20170057960-A1 INDOLIN-2-ONE AND 1,3-DIHYDRO-PYRROLO[3,2-c]PYRIDIN-2-ONE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2017-03-02 — — 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-10385050-B2 Indolin-2-one and 1,3-dihydro-pyrrolo[3,2-c]pyridin-2-one derivatives TPH1, TPH2, HTR1A HTR7 62/4885MEN1 472/4885KMT2A 3009/4885
US-20190016719-A1 INDOLIN-2-ONE AND 1,3-DIHYDRO-PYRROLO[3,2-c]PYRIDIN-2-ONE DERIVATIVES TPH1, TPH2, HTR1A HTR7 62/4885MEN1 472/4885KMT2A 3009/4885
US-20170057960-A1 INDOLIN-2-ONE AND 1,3-DIHYDRO-PYRROLO[3,2-c]PYRIDIN-2-ONE DERIVATIVES TPH1, TPH2, HTR1A HTR7 62/4885MEN1 472/4885KMT2A 3009/4885
US-10112938-B2 Indolin-2-one and 1,3-dihydro-pyrrolo[3,2-c]pyridin-2-one derivatives TPH1, TPH2, HTR1A HTR7 62/4885MEN1 472/4885KMT2A 3009/4885

“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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