SCHEMBL19477129

SCHEMBL19477129

COc1cc2c(C)cc(=O)[nH]c2cc1OCCCN1CCCC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SPIN1 Q9Y657 3/20 0.54
▸ KDM4E B2RXH2 2/20 0.53
▸ ALDH1A1 P00352 2/20 0.53
▸ HSD17B10 Q99714 2/20 0.53
▸ ALOX15 P16050 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ EHMT2 Q96KQ7 8/20 0.51
▸ EHMT1 Q9H9B1 8/20 0.51
▸ HPGD P15428 1/20 0.50
▸ ACHE P22303 1/20 0.48
▸ KDR P35968 2/20 0.48
▸ PLK4 O00444 1/20 0.48
▸ GAK O14976 1/20 0.48
▸ EPHB6 O15197 1/20 0.48
▸ RIPK2 O43353 1/20 0.48
▸ ERN1 O75460 1/20 0.48
▸ STK10 O94804 1/20 0.48
▸ MAP4K4 O95819 1/20 0.48
▸ CHEK2 O96017 1/20 0.48
▸ ABL1 P00519 1/20 0.48

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
SCHEMBL30474838 0.84 KDM4E (0.60) SPIN1KDM4EALDH1A1HSD17B10ALOX15
SCHEMBL19477138 0.82 EHMT2 (0.51) SPIN1KDM4EALDH1A1HSD17B10ALOX15
SCHEMBL20504600 0.80 KDM4E (0.64) SPIN1KDM4EALDH1A1HSD17B10ALOX15
SCHEMBL23784367 0.80 EHMT2 (0.52) SPIN1KDM4EALDH1A1HSD17B10ALOX15
SCHEMBL20580845 0.79 EHMT2 (0.53) SPIN1EHMT2EHMT1KDRPLK4
Hydrochloric Acid SCHEMBL20581101 0.79 EHMT2 (0.51) SPIN1KDM4EALDH1A1HSD17B10ALOX15
SCHEMBL6431234 0.78 EHMT2 (0.53) SPIN1EHMT2EHMT1ACHE
SCHEMBL19146396 0.78 NQO2 (0.60) KDM4EALDH1A1KMT2AHPGD
SCHEMBL20581299 0.77 EHMT2 (0.57) SPIN1EHMT2EHMT1KDRPLK4
SCHEMBL4373778 0.77 EHMT2 (0.52) SPIN1KDM4EALDH1A1HSD17B10ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3442947-B1 AMINE-SUBSTITUTED ARYL OR HETEROARYL COMPOUNDS AS EHMT1 AND EHMT2 INHIBITORS EPIZYME INC (US) 2023-06-07 — — EP disclosed
US-20210213014-A1 METHODS OF USING EHMT2 INHIBITORS IN IMMUNOTHERAPIES Epizyme, Inc. 2021-07-15 — — US disclosed
US-20210198277-A1 AMINE-SUBSTITUTED ARYL OR HETEROARYL COMPOUNDS Epizyme, Inc. 2021-07-01 — — US disclosed
US-20170355712-A1 AMINE-SUBSTITUTED ARYL OR HETEROARYL COMPOUNDS Epizyme, Inc. 2017-12-14 — — US disclosed
US-20170355712-A1 AMINE-SUBSTITUTED ARYL OR HETEROARYL COMPOUNDS Epizyme, Inc. 2017-12-14 — — US disclosed
WO-2017181177-A1 AMINE-SUBSTITUTED ARYL OR HETEROARYL COMPOUNDS AS EHMT1 AND EHMT2 INHIBITORS Epizyme, Inc. (US) 2017-10-19 — — WO 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-20170355712-A1 AMINE-SUBSTITUTED ARYL OR HETEROARYL COMPOUNDS SHMT1, BHMT, BHMT2 SPIN1 1460/4885KDM4E 220/4885ALDH1A1 185/4885
US-20210198277-A1 AMINE-SUBSTITUTED ARYL OR HETEROARYL COMPOUNDS SHMT1, BHMT, BHMT2 SPIN1 1460/4885KDM4E 220/4885ALDH1A1 185/4885
US-20210213014-A1 METHODS OF USING EHMT2 INHIBITORS IN IMMUNOTHERAPIES EHMT2, BHMT2, BHMT SPIN1 3829/4885KDM4E 212/4885ALDH1A1 799/4885

“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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