SCHEMBL199221

SCHEMBL199221

O=C(O)c1cnc(O)c(Cl)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.54
HCAR2 Q8TDS4 4/20 0.48
NAPRT Q6XQN6 1/20 0.48
TSHR P16473 3/20 0.47
SRD5A2 P31213 1/20 0.46
MGAM O43451 1/20 0.43
P4HA1 P13674 2/20 0.42
P4HTM Q9NXG6 2/20 0.42
TPMT P51580 2/20 0.42
ALOX15 P16050 2/20 0.41
MIF P14174 1/20 0.41
HCAR1 Q9BXC0 1/20 0.41
PLAU P00749 1/20 0.41
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39
GABRP O00591 1/20 0.39
GABRD O14764 1/20 0.39
GABRA1 P14867 1/20 0.39
GABRB1 P18505 1/20 0.39
GABRG2 P18507 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
SCHEMBL2922164 0.83 NAPRT (0.39) TTRHCAR2NAPRTTSHRSRD5A2
SCHEMBL9195960 0.82 CA5A (0.40) TTRNAPRTTPMTALDH1A1MEN1
SCHEMBL232290 0.81 HCAR2 (0.50) TTRHCAR2NAPRTTSHRSRD5A2
SCHEMBL29365646 0.81 HCAR2 (0.50) TTRHCAR2NAPRTTSHRSRD5A2
SCHEMBL3650453 0.79 HCAR2 (0.48) TTRHCAR2NAPRTTSHRSRD5A2
Hydrochloric Acid SCHEMBL7476482 0.79 HCAR2 (0.48) TTRHCAR2NAPRTTSHRMGAM
SCHEMBL27751624 0.78 KDM4E (0.50) HCAR2NAPRTTSHRMGAMP4HA1
SCHEMBL8061081 0.78 GABRP (0.47) TTRHCAR2NAPRTTSHRMGAM
SCHEMBL487373 0.78 HCAR2 (0.47) TTRHCAR2NAPRTTSHRSRD5A2
SCHEMBL1105964 0.78 HCAR2 (0.47) TTRHCAR2NAPRTTSHRSRD5A2

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 144 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5939568-A Accelerated catalysis of olefinic epoxidations THE SCRIPPS RESEARCH INSTITUTE (US) 1999-08-17 US claimed
WO-1998033786-A9 ACCELERATED CATALYSIS OF OLEFINIC EPOXIDATIONS 1998-12-30 WO claimed
WO-1998033786-A1 ACCELERATED CATALYSIS OF OLEFINIC EPOXIDATIONS THE SCRIPPS RESEARCH INSTITUTE (US) 1998-08-06 WO claimed
US-4517368-A 2,3-Dichloro-5-iodopyridine and methods of making and using the same THE DOW CHEMICAL COMPANY (US) 1985-05-14 US claimed
CN-119080739-B Synthesis method of 5-chloro-6- (4- (ethoxycarbonyl) piperidin-1-yl) nicotinic acid 深圳智微通科技有限公司 2025-02-25 CN disclosed
CN-119080739-A Synthesis method of 5-chloro-6- (4- (ethoxycarbonyl) piperidin-1-yl) nicotinic acid 深圳智微通科技有限公司 2024-12-06 CN disclosed
CN-116836157-A Oxadiazole derivative and preparation method and application thereof 星希尔生物科技(上海)有限公司 2023-10-03 CN disclosed
WO-2023179366-A1 OXADIAZOLE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF 星希尔生物科技(上海)有限公司 2023-09-28 WO disclosed
CN-109836379-B Method for converting halogenated pyridine carboxylic acid into cyano-substituted pyridine carboxylic acid 济南韶远医药技术有限公司 2022-10-21 CN disclosed
US-10875888-B2 Steroid derivative FXR agonist CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2020-12-29 US disclosed
US-10442765-B2 Method for producing 2,3-dichloro-5-(trichloromethyl)pyridine CHEMINOVA A/S (DK) 2019-10-15 US disclosed
US-20180057459-A1 METHOD FOR PRODUCING 2,3-DICHLORO-5-(TRICHLOROMETHYL)PYRIDINE CHEMINOVA A/S (DK) 2018-03-01 US disclosed
US-4517368-A 2,3-Dichloro-5-iodopyridine and methods of making and using the same THE DOW CHEMICAL COMPANY (US) 1985-05-14 US disclosed
EP-0136593-A2 Novel halopyridines and methods of making THE DOW CHEMICAL COMPANY (US) 1985-04-10 EP disclosed
EP-0046653-B1 METHOD FOR CONVERTING CARBOXYLIC ACID GROUPS TO TRICHLOROMETHYL GROUPS THE DOW CHEMICAL COMPANY (US) 1984-05-16 EP disclosed
US-4419514-A Method for converting carboxylic acid groups to trichloromethyl groups THE DOW CHEMICAL COMPANY (US) 1983-12-06 US disclosed
US-4410530-A CARDIO-SELECTIVE B-RECEPTOR BLOCKING AGENTS AND STIMULANTS CIBA-GEIGY CORPORATION (US) 1983-10-18 US disclosed
EP-0046653-A1 Method for converting carboxylic acid groups to trichloromethyl groups THE DOW CHEMICAL COMPANY (US) 1982-03-03 EP disclosed
US-4195090-A ADRENERGIC BLOCKING AGENTS CIBA-GEIGY CORPORATION (US) 1980-03-25 US disclosed
US-4115575-A CARDIOVASCULAR DISORDERS CIBA-GEIGY CORPORATION (US) 1978-09-19 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 (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-20180057459-A1 METHOD FOR PRODUCING 2,3-DICHLORO-5-(TRICHLOROMETHYL)PYRIDINE CBR3, USP5, CDC5L TTR 4298/4885HCAR2 3294/4885NAPRT 2939/4885
US-10442765-B2 Method for producing 2,3-dichloro-5-(trichloromethyl)pyridine CBR3, USP5, CDC5L TTR 4298/4885HCAR2 3294/4885NAPRT 2939/4885
US-10875888-B2 Steroid derivative FXR agonist NR1H4, SLC10A1, FXR1 TTR 967/4885HCAR2 422/4885NAPRT 2009/4885

“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.