SCHEMBL19975792

SCHEMBL19975792

CCCCCC(=O)c1ccc(N(C)C)cc1

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 7/20 0.66
HTR7 P34969 1/20 0.56
HDAC11 Q96DB2 1/20 0.55
HDAC3 O15379 1/20 0.54
HDAC1 Q13547 1/20 0.54
HDAC2 Q92769 1/20 0.54
HDAC8 Q9BY41 1/20 0.54
THRA P10827 3/20 0.53
THRB P10828 3/20 0.53
ALDH1A1 P00352 2/20 0.52
MAPT P10636 2/20 0.52
HPGD P15428 2/20 0.52
STS P08842 4/20 0.51
KDM4E B2RXH2 1/20 0.51
NPC1 O15118 1/20 0.51
GAA P10253 1/20 0.51
RAB9A P51151 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51

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
SCHEMBL8139107 0.98 HSD17B3 (0.67) HSD17B3HTR7HDAC11HDAC3HDAC1
SCHEMBL10883603 0.98 HSD17B3 (0.67) HSD17B3HTR7HDAC11HDAC3HDAC1
SCHEMBL10999955 0.98 HSD17B3 (0.67) HSD17B3HTR7HDAC11HDAC3HDAC1
SCHEMBL6514676 0.95 HSD17B3 (0.65) HSD17B3HTR7HDAC11HDAC3HDAC1
SCHEMBL18806556 0.91 NPC1 (0.58) HSD17B3HTR7HDAC11HDAC3HDAC1
SCHEMBL18806578 0.91 NPC1 (0.58) HSD17B3HTR7HDAC11HDAC3HDAC1
SCHEMBL18806587 0.89 HSD17B3 (0.56) HSD17B3HTR7HDAC11HDAC3HDAC1
SCHEMBL10345229 0.87 HSD17B3 (0.62) HSD17B3HTR7HDAC11HDAC3HDAC1
SCHEMBL18753070 0.87 HSD17B3 (0.84) HSD17B3HTR7THRATHRBMAPT
SCHEMBL5420183 0.86 HPGD (0.52) HSD17B3HDAC11HDAC3HDAC1HDAC2

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-20180208695-A1 UV-ABSORBING POLYMERS AND FORMULATIONS THEREOF ISP INVESTMENTS LLC (US) 2018-07-26 US disclosed
US-9920152-B2 UV-absorbing polymers and formulations thereof ISP INVESTMENTS LLC (US) 2018-03-20 US disclosed
US-20170114173-A1 UV-ABSORBING POLYMERS AND FORMULATIONS THEREOF ISP INVESTMENTS LLC (US) 2017-04-27 US disclosed
US-9540474-B2 UV-absorbing polymers and formulations thereof ISP INVESTMENTS LLC (US) 2017-01-10 US disclosed
US-20160002384-A1 UV-ABSORBING POLYMERS AND FORMULATIONS THEREOF ISP INVESTMENTS INC. (US) 2016-01-07 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-20170114173-A1 UV-ABSORBING POLYMERS AND FORMULATIONS THEREOF PUF60, UACA, UMPS HSD17B3 3939/4885HTR7 1823/4885HDAC11 284/4885
US-20180208695-A1 UV-ABSORBING POLYMERS AND FORMULATIONS THEREOF PUF60, UACA, UMPS HSD17B3 3939/4885HTR7 1823/4885HDAC11 284/4885

“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.