SCHEMBL16088833

SCHEMBL16088833

O=C(O)Cc1ccccc1C(=O)Nc1ccc(CCO)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCAT2 O15382 2/20 0.73
ALDH1A1 P00352 1/20 0.61
ADRB2 P07550 1/20 0.61
KDM4E B2RXH2 1/20 0.58
LMNA P02545 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
FFAR1 O14842 1/20 0.57
DPP4 P27487 1/20 0.55
NR1H4 Q96RI1 4/20 0.54
KDR P35968 1/20 0.52
HDAC6 Q9UBN7 1/20 0.50
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C19 P33261 1/20 0.49
PTGDR2 Q9Y5Y4 1/20 0.48
ALOX15 P16050 1/20 0.48
SMO Q99835 1/20 0.47
NPC1 O15118 1/20 0.47
TP53 P04637 1/20 0.47
RAB9A P51151 1/20 0.47

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
SCHEMBL16088715 0.88 BCAT2 (0.71) BCAT2ALDH1A1ADRB2KDM4ELMNA
SCHEMBL12614698 0.82 ALDH1A1 (0.67) ALDH1A1ADRB2KDM4ELMNASMN1; SMN2
SCHEMBL5228042 0.81 BCAT2 (0.79) BCAT2ALDH1A1ADRB2KDM4ELMNA
SCHEMBL1072315 0.81 ALDH1A1 (0.73) BCAT2ALDH1A1ADRB2KDM4ELMNA
SCHEMBL12700237 0.78 BCAT2 (0.73) BCAT2ALDH1A1ADRB2KDM4ELMNA
SCHEMBL8867704 0.77 PTPN1 (0.62) ALDH1A1KDM4ESMN1; SMN2NR1H4HDAC6
SCHEMBL18132588 0.75 FFAR1 (0.73) BCAT2ALDH1A1FFAR1NR1H4CYP1A2
SCHEMBL12614440 0.74 ALDH1A1 (0.63) ALDH1A1ADRB2KDM4ELMNASMN1; SMN2
SCHEMBL6239639 0.74 NR1H4 (0.73) BCAT2ALDH1A1LMNAFFAR1NR1H4
SCHEMBL8868654 0.74 EPHX1 (0.63) KDM4ESMN1; SMN2NPC1TP53RAB9A

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 BCAT2 2181/4885ALDH1A1 52/4885ADRB2 4382/4885
US-20160045514-A1 COMPOUNDS AND METHODS FOR INDUCING CHONDROGENESIS COL2A1, BMP4, COL1A1 BCAT2 2181/4885ALDH1A1 52/4885ADRB2 4382/4885
US-20200188407-A1 COMPOUNDS AND METHODS FOR INDUCING CHONDROGENESIS COL2A1, BMP4, COL1A1 BCAT2 2181/4885ALDH1A1 52/4885ADRB2 4382/4885
US-20140271955-A1 COMPOUNDS AND METHODS FOR INDUCING CHONDROGENESIS COL2A1, BMP4, COL1A1 BCAT2 2181/4885ALDH1A1 52/4885ADRB2 4382/4885

“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.