SCHEMBL19002852

SCHEMBL19002852

Cc1ccc(Cl)c(N2CCCC2=O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.50
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
TP53 P04637 1/20 0.45
FFAR1 O14842 1/20 0.43
FFAR4 Q5NUL3 1/20 0.43
HTR1A P08908 1/20 0.43
ADRA1A P35348 1/20 0.43
ADRA1B P35368 1/20 0.43
ALDH1A1 P00352 3/20 0.42
CDK2 P24941 1/20 0.41
LMNA P02545 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
KDM4E B2RXH2 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
AKR1C3 P42330 1/20 0.39
USP2 O75604 1/20 0.39

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
SCHEMBL8305501 0.87 HSD17B10 (0.50) HSD17B10KMT2AMEN1TP53ALDH1A1
SCHEMBL8305486 0.83 HSD17B10 (0.45) HSD17B10KMT2AMEN1TP53ALDH1A1
SCHEMBL4298970 0.82 HSD17B10 (0.47) HSD17B10KMT2AMEN1FFAR1FFAR4
SCHEMBL8270290 0.81 HSD17B10 (0.50) HSD17B10KMT2AMEN1TP53ALDH1A1
SCHEMBL19049642 0.80 HSD17B10 (0.43) HSD17B10TP53FFAR1FFAR4HTR1A
SCHEMBL18997973 0.80 HSD17B10 (0.43) HSD17B10FFAR1FFAR4HTR1AADRA1B
SCHEMBL2760313 0.80 HSD17B10 (0.57) HSD17B10KMT2AMEN1TP53ALDH1A1
SCHEMBL17244485 0.79 HSD17B10 (0.64) HSD17B10KMT2AMEN1TP53ALDH1A1
SCHEMBL8560632 0.77 HSD17B10 (0.46) HSD17B10KMT2AMEN1TP53ALDH1A1
SCHEMBL22864649 0.77 HSD17B10 (0.54) HSD17B10KMT2AMEN1TP53ALDH1A1

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-10940139-B2 Compounds that interact with the Ras superfamily for the treatment of cancers, inflammatory diseases, rasopathies, and fibrotic disease SHY Therapeutics LLC (US) 2021-03-09 US disclosed
US-10870657-B2 Compounds for the treatment of cancer and inflammatory disease SHY Therapeutics LLC (US) 2020-12-22 US disclosed
US-20200121660-A1 COMPOUNDS THAT INTERACT WITH THE RAS SUPERFAMILY FOR THE TREATMENT OF CANCERS, INFLAMMATORY DISEASES, RASOPATHIES, AND FIBROTIC DISEASE SHY THERAPEUTICS, INC. 2020-04-23 US disclosed
US-20190218229-A1 COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMTORY DISEASE SHY Therapeutics LLC 2019-07-18 US disclosed
US-20170174699-A1 COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMATORY DISEASE SHY Therapeutics LLC 2017-06-22 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 (5 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-20190218229-A1 COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMTORY DISEASE MAPK1, MAPK6, MAP3K1 HSD17B10 2117/4885KMT2A 3181/4885MEN1 3536/4885
US-10870657-B2 Compounds for the treatment of cancer and inflammatory disease MAPK6, MAP3K6, MAPK4 HSD17B10 2132/4885KMT2A 3544/4885MEN1 4080/4885
US-20200121660-A1 COMPOUNDS THAT INTERACT WITH THE RAS SUPERFAMILY FOR THE TREATMENT OF CANCERS, INFLAMMATORY DISEASES, RASOPATHIES, AND FIBROTIC DISEASE HRAS, KRAS, NRAS HSD17B10 3613/4885KMT2A 4024/4885MEN1 1612/4885
US-10940139-B2 Compounds that interact with the Ras superfamily for the treatment of cancers, inflammatory diseases, rasopathies, and fibrotic disease HRAS, KRAS, NRAS HSD17B10 3613/4885KMT2A 4024/4885MEN1 1612/4885
US-20170174699-A1 COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMATORY DISEASE MAPK6, MAP3K6, MAPK4 HSD17B10 2132/4885KMT2A 3544/4885MEN1 4080/4885

“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.