SCHEMBL16088606

SCHEMBL16088606

COc1ccc(C#N)cc1NC(=O)c1ccccc1C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.65
▸ HTT P42858 2/20 0.57
▸ RAB9A P51151 2/20 0.54
▸ LMNA P02545 2/20 0.54
▸ CHEK1 O14757 1/20 0.52
▸ PIM1 P11309 1/20 0.52
▸ MAPK8 P45983 1/20 0.52
▸ CLK4 Q9HAZ1 1/20 0.52
▸ ALDH1A1 P00352 3/20 0.51
▸ CREBBP Q92793 1/20 0.50
▸ PPARG P37231 1/20 0.50
▸ PPARA Q07869 1/20 0.50
▸ NR1H4 Q96RI1 1/20 0.50
▸ NPSR1 Q6W5P4 2/20 0.49
▸ POLB P06746 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ METAP2 P50579 1/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ NPC1 O15118 1/20 0.49
▸ KCNH2 Q12809 1/20 0.49

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
SCHEMBL7828780 0.82 KMT2A (0.72) KMT2AHTTRAB9ALMNACHEK1
SCHEMBL11620489 0.82 KMT2A (0.72) KMT2ARAB9ALMNAALDH1A1NPSR1
SCHEMBL16088612 0.81 HTT (0.61) KMT2AHTTLMNAALDH1A1PPARG
SCHEMBL16088827 0.81 HTT (0.61) KMT2AHTTALDH1A1PPARGNR1H4
SCHEMBL6802094 0.80 KMT2A (1.00) KMT2AHTTRAB9ALMNACHEK1
SCHEMBL29033307 0.78 ALDH1A1 (0.56) KMT2AHTTCHEK1ALDH1A1MEN1
SCHEMBL30474632 0.78 ALDH1A1 (0.56) KMT2AHTTCHEK1ALDH1A1MEN1
SCHEMBL16088626 0.78 ALDH1A1 (0.64) KMT2AHTTRAB9ALMNAALDH1A1
SCHEMBL546183 0.76 AR (0.50) KMT2AALDH1A1POLBL3MBTL1KDM4E
SCHEMBL25263510 0.76 TP53 (0.52) KMT2ACHEK1ALDH1A1POLBMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2968330-B1 COMPOUNDS AND METHODS FOR INDUCING CHONDROGENESIS SCRIPPS RESEARCH INST (US) 2021-09-29 — — EP disclosed
US-11045476-B2 Compounds and methods for inducing chondrogenesis THE SCRIPPS RESEARCH INSTITUTE (US) 2021-06-29 — — US disclosed
US-20200188407-A1 COMPOUNDS AND METHODS FOR INDUCING CHONDROGENESIS THE SCRIPPS RESEARCH INSTITUTE 2020-06-18 — — US disclosed
US-9452170-B2 Compounds and methods for inducing chondrogenesis THE CALIFORNIA INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2016-09-27 — — US disclosed
US-9452170-B2 Compounds and methods for inducing chondrogenesis THE CALIFORNIA INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2016-09-27 — — US disclosed
US-20160045514-A1 COMPOUNDS AND METHODS FOR INDUCING CHONDROGENESIS THE CALIFORNIA INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2016-02-18 — — US disclosed
US-20160045514-A1 COMPOUNDS AND METHODS FOR INDUCING CHONDROGENESIS THE CALIFORNIA INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2016-02-18 — — US disclosed
WO-2014151953-A1 COMPOUNDS AND METHODS FOR INDUCING CHONDROGENESIS THE CALIFORNIA INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2014-09-25 — — WO disclosed
US-20140271955-A1 COMPOUNDS AND METHODS FOR INDUCING CHONDROGENESIS THE SCRIPPS RESEARCH INSTITUTE (US) 2014-09-18 — — 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-11045476-B2 Compounds and methods for inducing chondrogenesis COL2A1, BMP4, COL1A1 KMT2A 3871/4885HTT 4161/4885RAB9A 3139/4885
US-20160045514-A1 COMPOUNDS AND METHODS FOR INDUCING CHONDROGENESIS COL2A1, BMP4, COL1A1 KMT2A 3871/4885HTT 4161/4885RAB9A 3139/4885
US-20200188407-A1 COMPOUNDS AND METHODS FOR INDUCING CHONDROGENESIS COL2A1, BMP4, COL1A1 KMT2A 3871/4885HTT 4161/4885RAB9A 3139/4885
US-20140271955-A1 COMPOUNDS AND METHODS FOR INDUCING CHONDROGENESIS COL2A1, BMP4, COL1A1 KMT2A 3871/4885HTT 4161/4885RAB9A 3139/4885

“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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